spark_compound_id stringlengths 11 11 | spark_SMILES stringlengths 13 285 | spark_synonyms stringclasses 44
values | spark_batch_name int64 1 49 | spark_compound_batch_id stringlengths 15 15 | compound_salt stringclasses 19
values | source_compound_name stringclasses 187
values | pubchem_id float64 | pubmed_id float64 21.3M 30M ⌀ | doi stringclasses 12
values | source_compound_id stringclasses 154
values | publication_date stringdate 2018-09-28 00:00:00 2021-03-03 00:00:00 | publication_reference stringclasses 16
values | spark_mic_project_name stringclasses 1
value | mic_micrograms_per_ml stringlengths 1 10 | mic_reported_as stringclasses 4
values | test_article_type stringclasses 2
values | mic_micromolar stringlengths 1 9 | mic_ineq_operator stringclasses 3
values | plain_mic_micromolar float64 0 576 | plain_pmic float64 3.24 9.06 | pmic float64 2.24 10.1 | growth_inhibition_threshold stringclasses 3
values | species stringclasses 1
value | strain_name stringclasses 5
values | strain_name_other stringclasses 5
values | is_clinical_isolate stringclasses 2
values | accumulation_phenotype stringclasses 1
value | strain_genotype stringclasses 2
values | solvent stringclasses 3
values | media stringclasses 7
values | mic_method stringclasses 4
values | curator_notes stringclasses 11
values | curation_date stringdate 2018-09-06 00:00:00 2021-02-21 00:00:00 ⌀ | subset_date stringdate 2020-04-09 00:00:00 2020-11-24 00:00:00 ⌀ | spark_extractor stringclasses 3
values | full_strain_name stringclasses 5
values | full_strain_name_with_genotype stringclasses 5
values | id stringlengths 12 12 | smiles stringlengths 11 275 | inchikey stringlengths 27 27 | scaffold stringlengths 5 143 ⌀ | mwt float64 123 1.7k | clogp float64 -6.74 7.49 | tpsa float64 3.24 697 | is_train bool 1
class | is_test bool 1
class | is_validation bool 1
class |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
SPK-0255431 | OC(=O)COc1ccc2ncc(F)c(CCC34CCC(CC3)(CO4)NCc3ccc4OCC(=O)Nc4n3)c2n1 | null | 1 | SPK-0255431-001 | No Salt, free base or acid | null | null | null | null | null | 18/11/2020 | Merck & Kyorin - GyrAB/ParCE inhibitors | Curated Data | > 16.0 | MIC | Test article | > 29.8 | gt | 29.8 | 4.525784 | 3.525784 | Visual | Acinetobacter baumannii | IID876 | null | No | Wild type | Wild type | DMSO | CAMHB | CLSI broth microdilution | TKW | 06/11/2020 | null | null | Acinetobacter baumannii IID876 | Acinetobacter baumannii IID876 Wild type | SCB-51756815 | O=C(O)COc1ccc2ncc(F)c(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)c2n1 | UCZLNKKAXJHWOE-UHFFFAOYSA-N | O=C1COc2ccc(CNC34CCC(CCc5ccnc6cccnc56)(CC3)OC4)nc2N1 | 537.202362 | 2.7624 | 144.79 | true | false | false |
SPK-0255430 | NCCOc1ccc2ncc(F)c(CCC34CCC(CC3)(CO4)NCc3ccc4OCC(=O)Nc4n3)c2n1 | null | 1 | SPK-0255430-001 | No Salt, free base or acid | null | null | null | null | null | 18/11/2020 | Merck & Kyorin - GyrAB/ParCE inhibitors | Curated Data | 1 | MIC | Test article | 1.91 | eq | 1.91 | 5.718967 | 5.718967 | Visual | Acinetobacter baumannii | IID876 | null | No | Wild type | Wild type | DMSO | CAMHB | CLSI broth microdilution | TKW | 06/11/2020 | null | null | Acinetobacter baumannii IID876 | Acinetobacter baumannii IID876 Wild type | SCB-20663818 | NCCOc1ccc2ncc(F)c(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)c2n1 | SZLKARMZUAFJQJ-UHFFFAOYSA-N | O=C1COc2ccc(CNC34CCC(CCc5ccnc6cccnc56)(CC3)OC4)nc2N1 | 522.239082 | 2.6365 | 133.51 | true | false | false |
SPK-0255429 | OCCOc1ccc2ncc(F)c(CCC34CCC(CC3)(CO4)NCc3ccc4OCC(=O)Nc4n3)c2n1 | null | 1 | SPK-0255429-001 | No Salt, free base or acid | null | null | null | null | null | 18/11/2020 | Merck & Kyorin - GyrAB/ParCE inhibitors | Curated Data | 1 | MIC | Test article | 1.91 | eq | 1.91 | 5.718967 | 5.718967 | Visual | Acinetobacter baumannii | IID876 | null | No | Wild type | Wild type | DMSO | CAMHB | CLSI broth microdilution | TKW | 06/11/2020 | null | null | Acinetobacter baumannii IID876 | Acinetobacter baumannii IID876 Wild type | SCB-56628253 | O=C1COc2ccc(CNC34CCC(CCc5c(F)cnc6ccc(OCCO)nc56)(CC3)OC4)nc2N1 | HBISBEJOUCABCD-UHFFFAOYSA-N | O=C1COc2ccc(CNC34CCC(CCc5ccnc6cccnc56)(CC3)OC4)nc2N1 | 523.223097 | 2.6701 | 127.72 | true | false | false |
SPK-0255428 | CCOC(=O)COc1ccc2ncc(F)c(CCC34CCC(CC3)(CO4)NCc3ccc4OCC(=O)Nc4n3)c2n1 | null | 1 | SPK-0255428-001 | No Salt, free base or acid | null | null | null | null | null | 18/11/2020 | Merck & Kyorin - GyrAB/ParCE inhibitors | Curated Data | 8 | MIC | Test article | 14.1 | eq | 14.1 | 4.850781 | 4.850781 | Visual | Acinetobacter baumannii | IID876 | null | No | Wild type | Wild type | DMSO | CAMHB | CLSI broth microdilution | TKW | 06/11/2020 | null | null | Acinetobacter baumannii IID876 | Acinetobacter baumannii IID876 Wild type | SCB-67282821 | CCOC(=O)COc1ccc2ncc(F)c(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)c2n1 | OVFYQUXTBGMJAZ-UHFFFAOYSA-N | O=C1COc2ccc(CNC34CCC(CCc5ccnc6cccnc56)(CC3)OC4)nc2N1 | 565.233662 | 3.2409 | 133.79 | true | false | false |
SPK-0255427 | COc1nc2c(CCC34CCC(CC3)(CO4)[NH2+]Cc3ccc4OCC(=O)Nc4n3)ccnc2cc1Cl | null | 1 | SPK-0255427-001 | 1.0 Hydrochloride | null | null | null | null | null | 18/11/2020 | Merck & Kyorin - GyrAB/ParCE inhibitors | Curated Data | 32 | MIC | Test article | 58.6 | eq | 58.6 | 4.232102 | 4.232102 | Visual | Acinetobacter baumannii | IID876 | null | No | Wild type | Wild type | DMSO | CAMHB | CLSI broth microdilution | TKW | 06/11/2020 | null | null | Acinetobacter baumannii IID876 | Acinetobacter baumannii IID876 Wild type | SCB-79171442 | COc1nc2c(CCC34CCC([NH2+]Cc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)ccnc2cc1Cl | BMSCZCBEBYCRCA-UHFFFAOYSA-O | O=C1COc2ccc(C[NH2+]C34CCC(CCc5ccnc6cccnc56)(CC3)OC4)nc2N1 | 510.190259 | 2.7957 | 112.07 | true | false | false |
SPK-0255426 | Fc1cnc2cc(Cl)cnc2c1CCC12CCC(CC1)(CO2)[NH2+]Cc1ccc2OCC(=O)Nc2n1 | null | 1 | SPK-0255426-001 | 1.0 Hydrochloride | null | null | null | null | null | 18/11/2020 | Merck & Kyorin - GyrAB/ParCE inhibitors | Curated Data | > 32.0 | MIC | Test article | > 59.9 | gt | 59.9 | 4.222573 | 3.222573 | Visual | Acinetobacter baumannii | IID876 | null | No | Wild type | Wild type | DMSO | CAMHB | CLSI broth microdilution | TKW | 06/11/2020 | null | null | Acinetobacter baumannii IID876 | Acinetobacter baumannii IID876 Wild type | SCB-11330640 | O=C1COc2ccc(C[NH2+]C34CCC(CCc5c(F)cnc6cc(Cl)cnc56)(CC3)OC4)nc2N1 | JFWFOFVSNIMPLO-UHFFFAOYSA-O | O=C1COc2ccc(C[NH2+]C34CCC(CCc5ccnc6cccnc56)(CC3)OC4)nc2N1 | 498.170272 | 2.9262 | 102.84 | true | false | false |
SPK-0255425 | COc1cc(C)c2nccc(CCC34CCC(CC3)(CO4)[NH2+]Cc3ccc4OCC(=O)Nc4n3)c2n1 | null | 1 | SPK-0255425-001 | 1.0 Hydrochloride | null | null | null | null | null | 18/11/2020 | Merck & Kyorin - GyrAB/ParCE inhibitors | Curated Data | 8 | MIC | Test article | 15.2 | eq | 15.2 | 4.818156 | 4.818156 | Visual | Acinetobacter baumannii | IID876 | null | No | Wild type | Wild type | DMSO | CAMHB | CLSI broth microdilution | TKW | 06/11/2020 | null | null | Acinetobacter baumannii IID876 | Acinetobacter baumannii IID876 Wild type | SCB-12824511 | COc1cc(C)c2nccc(CCC34CCC([NH2+]Cc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)c2n1 | GRSZSNHZRCZJJC-UHFFFAOYSA-O | O=C1COc2ccc(C[NH2+]C34CCC(CCc5ccnc6cccnc56)(CC3)OC4)nc2N1 | 490.244881 | 2.45072 | 112.07 | true | false | false |
SPK-0255424 | Clc1cnc2c(CCC34CCC(CC3)(CO4)[NH2+]Cc3ccc4OCC(=O)Nc4n3)ccnc2c1 | null | 1 | SPK-0255424-001 | 1.0 Hydrochloride | null | null | null | null | null | 18/11/2020 | Merck & Kyorin - GyrAB/ParCE inhibitors | Curated Data | > 64.0 | MIC | Test article | > 124 | gt | 124 | 3.906578 | 2.906578 | Visual | Acinetobacter baumannii | IID876 | null | No | Wild type | Wild type | DMSO | CAMHB | CLSI broth microdilution | TKW | 06/11/2020 | null | null | Acinetobacter baumannii IID876 | Acinetobacter baumannii IID876 Wild type | SCB-62471766 | O=C1COc2ccc(C[NH2+]C34CCC(CCc5ccnc6cc(Cl)cnc56)(CC3)OC4)nc2N1 | KYYFTAYPKMYUQW-UHFFFAOYSA-O | O=C1COc2ccc(C[NH2+]C34CCC(CCc5ccnc6cccnc56)(CC3)OC4)nc2N1 | 480.179694 | 2.7871 | 102.84 | true | false | false |
SPK-0255423 | COc1cnc2c(CCC34CCC(CC3)(CO4)[NH2+]Cc3ccc4OCC(=O)Nc4n3)ccnc2c1 | null | 1 | SPK-0255423-001 | 1.0 Hydrochloride | null | null | null | null | null | 18/11/2020 | Merck & Kyorin - GyrAB/ParCE inhibitors | Curated Data | > 64.0 | MIC | Test article | > 125 | gt | 125 | 3.90309 | 2.90309 | Visual | Acinetobacter baumannii | IID876 | null | No | Wild type | Wild type | DMSO | CAMHB | CLSI broth microdilution | TKW | 06/11/2020 | null | null | Acinetobacter baumannii IID876 | Acinetobacter baumannii IID876 Wild type | SCB-41981955 | COc1cnc2c(CCC34CCC([NH2+]Cc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)ccnc2c1 | FSDVIKPFFCMUOP-UHFFFAOYSA-O | O=C1COc2ccc(C[NH2+]C34CCC(CCc5ccnc6cccnc56)(CC3)OC4)nc2N1 | 476.229231 | 2.1423 | 112.07 | true | false | false |
SPK-0255422 | COc1ccc2ncc(OC)c(CCC34CCC(CC3)(CO4)NCc3ccc4OCC(=O)Nc4n3)c2n1 | null | 1 | SPK-0255422-001 | No Salt, free base or acid | null | null | null | null | null | 18/11/2020 | Merck & Kyorin - GyrAB/ParCE inhibitors | Curated Data | 8 | MIC | Test article | 15.8 | eq | 15.8 | 4.801343 | 4.801343 | Visual | Acinetobacter baumannii | IID876 | null | No | Wild type | Wild type | DMSO | CAMHB | CLSI broth microdilution | TKW | 06/11/2020 | null | null | Acinetobacter baumannii IID876 | Acinetobacter baumannii IID876 Wild type | SCB-74293129 | COc1ccc2ncc(OC)c(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)c2n1 | JHEPPJMJLFAYSQ-UHFFFAOYSA-N | O=C1COc2ccc(CNC34CCC(CCc5ccnc6cccnc56)(CC3)OC4)nc2N1 | 505.232519 | 3.1771 | 116.72 | true | false | false |
SPK-0255421 | COc1ccc2ncc(F)c(CCC34CCC(CC3)(CO4)NCc3cc(F)c(O)c(OC)c3)c2n1 | null | 1 | SPK-0255421-001 | No Salt, free base or acid | null | null | null | null | null | 18/11/2020 | Merck & Kyorin - GyrAB/ParCE inhibitors | Curated Data | > 8.00 | MIC | Test article | > 16.5 | gt | 16.5 | 4.782516 | 3.782516 | Visual | Acinetobacter baumannii | IID876 | null | No | Wild type | Wild type | DMSO | CAMHB | CLSI broth microdilution | TKW | 06/11/2020 | null | null | Acinetobacter baumannii IID876 | Acinetobacter baumannii IID876 Wild type | SCB-16905897 | COc1ccc2ncc(F)c(CCC34CCC(NCc5cc(F)c(O)c(OC)c5)(CC3)CO4)c2n1 | GPKWYSZGPBZQJA-UHFFFAOYSA-N | c1ccc(CNC23CCC(CCc4ccnc5cccnc45)(CC2)OC3)cc1 | 485.212613 | 4.435 | 85.73 | true | false | false |
SPK-0255413 | COc1ccc2ncc(F)c(CCC34CCC(CC3)(CO4)NCC3=Cc4ccccc4N(C)C3=O)c2n1 | null | 1 | SPK-0255413-001 | No Salt, free base or acid | null | null | null | null | null | 18/11/2020 | Merck & Kyorin - GyrAB/ParCE inhibitors | Curated Data | > 8.00 | MIC | Test article | > 15.9 | gt | 15.9 | 4.798603 | 3.798603 | Visual | Acinetobacter baumannii | IID876 | null | No | Wild type | Wild type | DMSO | CAMHB | CLSI broth microdilution | TKW | 06/11/2020 | null | null | Acinetobacter baumannii IID876 | Acinetobacter baumannii IID876 Wild type | SCB-74697737 | COc1ccc2ncc(F)c(CCC34CCC(NCc5cc6ccccc6n(C)c5=O)(CC3)CO4)c2n1 | JBJDEDAUTCYOMZ-UHFFFAOYSA-N | O=c1[nH]c2ccccc2cc1CNC12CCC(CCc3ccnc4cccnc34)(CC1)OC2 | 502.238019 | 4.4336 | 78.27 | true | false | false |
SPK-0255397 | COc1ccc2ncc(F)c(CCC34CCC(CC3)(CO4)NCc3cc(O)c(O)cn3)c2n1 | null | 1 | SPK-0255397-001 | No Salt, free base or acid | null | null | null | null | null | 18/11/2020 | Merck & Kyorin - GyrAB/ParCE inhibitors | Curated Data | > 8.00 | MIC | Test article | > 17.6 | gt | 17.6 | 4.754487 | 3.754487 | Visual | Acinetobacter baumannii | IID876 | null | No | Wild type | Wild type | DMSO | CAMHB | CLSI broth microdilution | TKW | 06/11/2020 | null | null | Acinetobacter baumannii IID876 | Acinetobacter baumannii IID876 Wild type | SCB-12223565 | COc1ccc2ncc(F)c(CCC34CCC(NCc5cc(O)c(O)cn5)(CC3)CO4)c2n1 | MEYJLQNZENUXIL-UHFFFAOYSA-N | c1ccc(CNC23CCC(CCc4ccnc5cccnc45)(CC2)OC3)nc1 | 454.201634 | 3.3879 | 109.62 | true | false | false |
SPK-0255395 | COc1ccc2ncc(F)c(CCC34CCC(CC3)(CO4)NCc3cc(OC)c(O)cn3)c2n1 | null | 1 | SPK-0255395-001 | No Salt, free base or acid | null | null | null | null | null | 18/11/2020 | Merck & Kyorin - GyrAB/ParCE inhibitors | Curated Data | > 16.0 | MIC | Test article | > 34.1 | gt | 34.1 | 4.467246 | 3.467246 | Visual | Acinetobacter baumannii | IID876 | null | No | Wild type | Wild type | DMSO | CAMHB | CLSI broth microdilution | TKW | 06/11/2020 | null | null | Acinetobacter baumannii IID876 | Acinetobacter baumannii IID876 Wild type | SCB-68931723 | COc1ccc2ncc(F)c(CCC34CCC(NCc5cc(OC)c(O)cn5)(CC3)CO4)c2n1 | ZIXLJNQVDHNHGT-UHFFFAOYSA-N | c1ccc(CNC23CCC(CCc4ccnc5cccnc45)(CC2)OC3)nc1 | 468.217284 | 3.6909 | 98.62 | true | false | false |
SPK-0255394 | COc1ccc2ncc(F)c(CCC34CCC(CC3)(CO4)NCc3cc(O)c(OC)cn3)c2n1 | null | 1 | SPK-0255394-001 | No Salt, free base or acid | null | null | null | null | null | 18/11/2020 | Merck & Kyorin - GyrAB/ParCE inhibitors | Curated Data | > 64.0 | MIC | Test article | > 137 | gt | 137 | 3.863279 | 2.863279 | Visual | Acinetobacter baumannii | IID876 | null | No | Wild type | Wild type | DMSO | CAMHB | CLSI broth microdilution | TKW | 06/11/2020 | null | null | Acinetobacter baumannii IID876 | Acinetobacter baumannii IID876 Wild type | SCB-26795857 | COc1ccc2ncc(F)c(CCC34CCC(NCc5cc(O)c(OC)cn5)(CC3)CO4)c2n1 | VKYRHOGJYMZJPC-UHFFFAOYSA-N | c1ccc(CNC23CCC(CCc4ccnc5cccnc45)(CC2)OC3)nc1 | 468.217284 | 3.6909 | 98.62 | true | false | false |
SPK-0255390 | COc1ccc2ncc(F)c(CCC34CCC(CC3)(CO4)NCc3cc(OC)c(OC)cn3)c2n1 | null | 1 | SPK-0255390-001 | No Salt, free base or acid | null | null | null | null | null | 18/11/2020 | Merck & Kyorin - GyrAB/ParCE inhibitors | Curated Data | > 16.0 | MIC | Test article | > 33.2 | gt | 33.2 | 4.478862 | 3.478862 | Visual | Acinetobacter baumannii | IID876 | null | No | Wild type | Wild type | DMSO | CAMHB | CLSI broth microdilution | TKW | 06/11/2020 | null | null | Acinetobacter baumannii IID876 | Acinetobacter baumannii IID876 Wild type | SCB-14364139 | COc1ccc2ncc(F)c(CCC34CCC(NCc5cc(OC)c(OC)cn5)(CC3)CO4)c2n1 | DXZLYGBXWVWNHP-UHFFFAOYSA-N | c1ccc(CNC23CCC(CCc4ccnc5cccnc45)(CC2)OC3)nc1 | 482.232934 | 3.9939 | 87.62 | true | false | false |
SPK-0255389 | COc1ccc2ncc(F)c(CCC34CCC(CC3)(CO4)NCc3cc4OCCOc4cn3)c2n1 | null | 1 | SPK-0255389-001 | No Salt, free base or acid | null | null | null | null | null | 18/11/2020 | Merck & Kyorin - GyrAB/ParCE inhibitors | Curated Data | 8 | MIC | Test article | 16.6 | eq | 16.6 | 4.779892 | 4.779892 | Visual | Acinetobacter baumannii | IID876 | null | No | Wild type | Wild type | DMSO | CAMHB | CLSI broth microdilution | TKW | 06/11/2020 | null | null | Acinetobacter baumannii IID876 | Acinetobacter baumannii IID876 Wild type | SCB-15648517 | COc1ccc2ncc(F)c(CCC34CCC(NCc5cc6c(cn5)OCCO6)(CC3)CO4)c2n1 | FUZXAPLNLCYVFD-UHFFFAOYSA-N | c1cnc2c(CCC34CCC(NCc5cc6c(cn5)OCCO6)(CC3)CO4)ccnc2c1 | 480.217284 | 3.7479 | 87.62 | true | false | false |
SPK-0255388 | COc1ccc2ncc(F)c(CCC34CCC(CC3)(CO4)NCc3cccc(n3)C#N)c2n1 | null | 1 | SPK-0255388-001 | No Salt, free base or acid | null | null | null | null | null | 18/11/2020 | Merck & Kyorin - GyrAB/ParCE inhibitors | Curated Data | > 16.0 | MIC | Test article | > 35.8 | gt | 35.8 | 4.446117 | 3.446117 | Visual | Acinetobacter baumannii | IID876 | null | No | Wild type | Wild type | DMSO | CAMHB | CLSI broth microdilution | TKW | 06/11/2020 | null | null | Acinetobacter baumannii IID876 | Acinetobacter baumannii IID876 Wild type | SCB-10129896 | COc1ccc2ncc(F)c(CCC34CCC(NCc5cccc(C#N)n5)(CC3)CO4)c2n1 | AATFAIISSPMJAN-UHFFFAOYSA-N | c1ccc(CNC23CCC(CCc4ccnc5cccnc45)(CC2)OC3)nc1 | 447.207053 | 3.84838 | 92.95 | true | false | false |
SPK-0255387 | COc1ccc2ncc(F)c(CCC34CCC(CC3)(CO4)NCc3ccc(C)c(F)c3)c2n1 | null | 1 | SPK-0255387-001 | No Salt, free base or acid | null | null | null | null | null | 18/11/2020 | Merck & Kyorin - GyrAB/ParCE inhibitors | Curated Data | > 16.0 | MIC | Test article | > 35.3 | gt | 35.3 | 4.452225 | 3.452225 | Visual | Acinetobacter baumannii | IID876 | null | No | Wild type | Wild type | DMSO | CAMHB | CLSI broth microdilution | TKW | 06/11/2020 | null | null | Acinetobacter baumannii IID876 | Acinetobacter baumannii IID876 Wild type | SCB-21005444 | COc1ccc2ncc(F)c(CCC34CCC(NCc5ccc(C)c(F)c5)(CC3)CO4)c2n1 | IAXGINDHSWYFJO-UHFFFAOYSA-N | c1ccc(CNC23CCC(CCc4ccnc5cccnc45)(CC2)OC3)cc1 | 453.222784 | 5.02922 | 56.27 | true | false | false |
SPK-0255385 | COc1ccc2nccc(CCC34CCC(CC3)(CO4)NCc3ccc4OCC(=O)Nc4n3)c2n1 | null | 1 | SPK-0255385-001 | No Salt, free base or acid | null | null | null | null | null | 18/11/2020 | Merck & Kyorin - GyrAB/ParCE inhibitors | Curated Data | 0.5 | MIC | Test article | 1.05 | eq | 1.05 | 5.978811 | 5.978811 | Visual | Acinetobacter baumannii | IID876 | null | No | Wild type | Wild type | DMSO | CAMHB | CLSI broth microdilution | TKW | 06/11/2020 | null | null | Acinetobacter baumannii IID876 | Acinetobacter baumannii IID876 Wild type | SCB-69802242 | COc1ccc2nccc(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)c2n1 | VGLLCLTVTFPDBG-UHFFFAOYSA-N | O=C1COc2ccc(CNC34CCC(CCc5ccnc6cccnc56)(CC3)OC4)nc2N1 | 475.221954 | 3.1685 | 107.49 | true | false | false |
SPK-0255385 | COc1ccc2nccc(CCC34CCC(CC3)(CO4)NCc3ccc4OCC(=O)Nc4n3)c2n1 | null | 2 | SPK-0255385-002 | 1.0 Hydrochloride | null | null | null | null | null | 18/11/2020 | Merck & Kyorin - GyrAB/ParCE inhibitors | Curated Data | 2 | MIC | Test article | 3.91 | eq | 3.91 | 5.407823 | 5.407823 | Visual | Acinetobacter baumannii | IID876 | null | No | Wild type | Wild type | DMSO | CAMHB | CLSI broth microdilution | TKW | 06/11/2020 | null | null | Acinetobacter baumannii IID876 | Acinetobacter baumannii IID876 Wild type | SCB-69802242 | COc1ccc2nccc(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)c2n1 | VGLLCLTVTFPDBG-UHFFFAOYSA-N | O=C1COc2ccc(CNC34CCC(CCc5ccnc6cccnc56)(CC3)OC4)nc2N1 | 475.221954 | 3.1685 | 107.49 | true | false | false |
SPK-0255384 | COc1ccc2ncc(Cl)c(CCC34CCC(CC3)(CO4)NCc3ccc4OCC(=O)Nc4n3)c2n1 | null | 1 | SPK-0255384-001 | No Salt, free base or acid | null | null | null | null | null | 18/11/2020 | Merck & Kyorin - GyrAB/ParCE inhibitors | Curated Data | 1 | MIC | Test article | 1.96 | eq | 1.96 | 5.707744 | 5.707744 | Visual | Acinetobacter baumannii | IID876 | null | No | Wild type | Wild type | DMSO | CAMHB | CLSI broth microdilution | TKW | 06/11/2020 | null | null | Acinetobacter baumannii IID876 | Acinetobacter baumannii IID876 Wild type | SCB-45894465 | COc1ccc2ncc(Cl)c(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)c2n1 | KORWOFIKLKGGQH-UHFFFAOYSA-N | O=C1COc2ccc(CNC34CCC(CCc5ccnc6cccnc56)(CC3)OC4)nc2N1 | 509.182982 | 3.8219 | 107.49 | true | false | false |
SPK-0255384 | COc1ccc2ncc(Cl)c(CCC34CCC(CC3)(CO4)NCc3ccc4OCC(=O)Nc4n3)c2n1 | null | 2 | SPK-0255384-002 | 1.0 Hydrochloride | null | null | null | null | null | 18/11/2020 | Merck & Kyorin - GyrAB/ParCE inhibitors | Curated Data | 1 | MIC | Test article | 1.83 | eq | 1.83 | 5.737549 | 5.737549 | Visual | Acinetobacter baumannii | IID876 | null | No | Wild type | Wild type | DMSO | CAMHB | CLSI broth microdilution | TKW | 06/11/2020 | null | null | Acinetobacter baumannii IID876 | Acinetobacter baumannii IID876 Wild type | SCB-45894465 | COc1ccc2ncc(Cl)c(CCC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)c2n1 | KORWOFIKLKGGQH-UHFFFAOYSA-N | O=C1COc2ccc(CNC34CCC(CCc5ccnc6cccnc56)(CC3)OC4)nc2N1 | 509.182982 | 3.8219 | 107.49 | true | false | false |
SPK-0255330 | CCCCCCc1ccc(cc1)-c1cn(C(C)C)c(N)n1 | null | 1 | SPK-0255330-001 | No Salt, free base or acid | PMID:28958847 - Cmpd : 2 | null | 28,958,847 | https://dx.doi.org/10.1016/j.bmc.2017.08.055 | 2 | 19/02/2021 | Barker 2017 Bioorg. Med. Chem. 25:5749 | Curated Data | 57.1 | MIC | Test article | 200 | eq | 200 | 3.69897 | 3.69897 | Visual | Acinetobacter baumannii | ATCC 17978 | 5377; NCDC KC 755 | No | Wild type | null | null | CAMHB | CLSI, broth microdilution | TKW | 08/02/2021 | 17/11/2020 | KVT | Acinetobacter baumannii ATCC 17978 | Acinetobacter baumannii ATCC 17978 | SCB-65348789 | CCCCCCc1ccc(-c2cn(C(C)C)c(N)n2)cc1 | HTZBKGMWAJFRAO-UHFFFAOYSA-N | c1ccc(-c2c[nH]cn2)cc1 | 285.220498 | 4.836 | 43.84 | true | false | false |
SPK-0255330 | CCCCCCc1ccc(cc1)-c1cn(C(C)C)c(N)n1 | null | 1 | SPK-0255330-001 | No Salt, free base or acid | PMID:28958847 - Cmpd : 2 | null | 28,958,847 | https://dx.doi.org/10.1016/j.bmc.2017.08.055 | 2 | 19/02/2021 | Barker 2017 Bioorg. Med. Chem. 25:5749 | Curated Data | > 57.1 | MIC | Test article | > 200 | gt | 200 | 3.69897 | 2.69897 | Visual | Acinetobacter baumannii | ATCC 17978 | 5377; NCDC KC 755 | No | Wild type | null | null | CAMHB | CLSI, broth microdilution | TKW | 08/02/2021 | 17/11/2020 | KVT | Acinetobacter baumannii ATCC 17978 | Acinetobacter baumannii ATCC 17978 | SCB-65348789 | CCCCCCc1ccc(-c2cn(C(C)C)c(N)n2)cc1 | HTZBKGMWAJFRAO-UHFFFAOYSA-N | c1ccc(-c2c[nH]cn2)cc1 | 285.220498 | 4.836 | 43.84 | true | false | false |
SPK-0255330 | CCCCCCc1ccc(cc1)-c1cn(C(C)C)c(N)n1 | null | 1 | SPK-0255330-001 | No Salt, free base or acid | PMID:28958847 - Cmpd : 2 | null | 28,958,847 | https://dx.doi.org/10.1016/j.bmc.2017.08.055 | 2 | 03/02/2021 | Barker 2013 Bioorg. Med. Chem. Lett. 23:2426 | Curated Data | 57.1 | MIC | Test article | 200 | eq | 200 | 3.69897 | 3.69897 | Visual | Acinetobacter baumannii | ATCC 17978 | 5377; NCDC KC 755 | No | Wild type | null | null | CAMHB | CLSI, broth microdilution | TKW | 08/02/2021 | null | null | Acinetobacter baumannii ATCC 17978 | Acinetobacter baumannii ATCC 17978 | SCB-65348789 | CCCCCCc1ccc(-c2cn(C(C)C)c(N)n2)cc1 | HTZBKGMWAJFRAO-UHFFFAOYSA-N | c1ccc(-c2c[nH]cn2)cc1 | 285.220498 | 4.836 | 43.84 | true | false | false |
SPK-0255330 | CCCCCCc1ccc(cc1)-c1cn(C(C)C)c(N)n1 | null | 1 | SPK-0255330-001 | No Salt, free base or acid | PMID:28958847 - Cmpd : 2 | null | 28,958,847 | https://dx.doi.org/10.1016/j.bmc.2017.08.055 | 2 | 03/02/2021 | Barker 2013 Bioorg. Med. Chem. Lett. 23:2426 | Curated Data | > 57.1 | MIC | Test article | > 200 | gt | 200 | 3.69897 | 2.69897 | Visual | Acinetobacter baumannii | ATCC 17978 | 5377; NCDC KC 755 | No | Wild type | null | null | CAMHB | CLSI, broth microdilution | TKW | 08/02/2021 | null | null | Acinetobacter baumannii ATCC 17978 | Acinetobacter baumannii ATCC 17978 | SCB-65348789 | CCCCCCc1ccc(-c2cn(C(C)C)c(N)n2)cc1 | HTZBKGMWAJFRAO-UHFFFAOYSA-N | c1ccc(-c2c[nH]cn2)cc1 | 285.220498 | 4.836 | 43.84 | true | false | false |
SPK-0255329 | CCCCCCc1ccc(cc1)-c1cn(CC)c(N)n1 | null | 1 | SPK-0255329-001 | No Salt, free base or acid | PMID:28958847 - Cmpd : 1 | null | 28,958,847 | https://dx.doi.org/10.1016/j.bmc.2017.08.055 | 1 | 19/02/2021 | Barker 2017 Bioorg. Med. Chem. 25:5749 | Curated Data | 27.1 | MIC | Test article | 99.8 | eq | 99.8 | 4.000869 | 4.000869 | Visual | Acinetobacter baumannii | ATCC 17978 | 5377; NCDC KC 755 | No | Wild type | null | null | CAMHB | CLSI, broth microdilution | TKW | 08/02/2021 | 17/11/2020 | KVT | Acinetobacter baumannii ATCC 17978 | Acinetobacter baumannii ATCC 17978 | SCB-36924945 | CCCCCCc1ccc(-c2cn(CC)c(N)n2)cc1 | HISBMIBTYNVKNY-UHFFFAOYSA-N | c1ccc(-c2c[nH]cn2)cc1 | 271.204848 | 4.275 | 43.84 | true | false | false |
SPK-0255329 | CCCCCCc1ccc(cc1)-c1cn(CC)c(N)n1 | null | 1 | SPK-0255329-001 | No Salt, free base or acid | PMID:28958847 - Cmpd : 1 | null | 28,958,847 | https://dx.doi.org/10.1016/j.bmc.2017.08.055 | 1 | 19/02/2021 | Barker 2017 Bioorg. Med. Chem. 25:5749 | Curated Data | > 54.3 | MIC | Test article | > 200 | gt | 200 | 3.69897 | 2.69897 | Visual | Acinetobacter baumannii | ATCC 17978 | 5377; NCDC KC 755 | No | Wild type | null | null | CAMHB | CLSI, broth microdilution | TKW | 08/02/2021 | 17/11/2020 | KVT | Acinetobacter baumannii ATCC 17978 | Acinetobacter baumannii ATCC 17978 | SCB-36924945 | CCCCCCc1ccc(-c2cn(CC)c(N)n2)cc1 | HISBMIBTYNVKNY-UHFFFAOYSA-N | c1ccc(-c2c[nH]cn2)cc1 | 271.204848 | 4.275 | 43.84 | true | false | false |
SPK-0255329 | CCCCCCc1ccc(cc1)-c1cn(CC)c(N)n1 | null | 1 | SPK-0255329-001 | No Salt, free base or acid | PMID:28958847 - Cmpd : 1 | null | 28,958,847 | https://dx.doi.org/10.1016/j.bmc.2017.08.055 | 1 | 03/02/2021 | Barker 2013 Bioorg. Med. Chem. Lett. 23:2426 | Curated Data | 27.1 | MIC | Test article | 99.8 | eq | 99.8 | 4.000869 | 4.000869 | Visual | Acinetobacter baumannii | ATCC 17978 | 5377; NCDC KC 755 | No | Wild type | null | null | CAMHB | CLSI, broth microdilution | TKW | 08/02/2021 | null | null | Acinetobacter baumannii ATCC 17978 | Acinetobacter baumannii ATCC 17978 | SCB-36924945 | CCCCCCc1ccc(-c2cn(CC)c(N)n2)cc1 | HISBMIBTYNVKNY-UHFFFAOYSA-N | c1ccc(-c2c[nH]cn2)cc1 | 271.204848 | 4.275 | 43.84 | true | false | false |
SPK-0255329 | CCCCCCc1ccc(cc1)-c1cn(CC)c(N)n1 | null | 1 | SPK-0255329-001 | No Salt, free base or acid | PMID:28958847 - Cmpd : 1 | null | 28,958,847 | https://dx.doi.org/10.1016/j.bmc.2017.08.055 | 1 | 03/02/2021 | Barker 2013 Bioorg. Med. Chem. Lett. 23:2426 | Curated Data | > 54.3 | MIC | Test article | > 200 | gt | 200 | 3.69897 | 2.69897 | Visual | Acinetobacter baumannii | ATCC 17978 | 5377; NCDC KC 755 | No | Wild type | null | null | CAMHB | CLSI, broth microdilution | TKW | 08/02/2021 | null | null | Acinetobacter baumannii ATCC 17978 | Acinetobacter baumannii ATCC 17978 | SCB-36924945 | CCCCCCc1ccc(-c2cn(CC)c(N)n2)cc1 | HISBMIBTYNVKNY-UHFFFAOYSA-N | c1ccc(-c2c[nH]cn2)cc1 | 271.204848 | 4.275 | 43.84 | true | false | false |
SPK-0255319 | CC(C)C[C@H](N)C(=O)NS(=O)(=O)c1ccccc1 | null | 1 | SPK-0255319-001 | No Salt, free base or acid | PMID:29456792 - Cmpd : 7j; IK-698 | null | 29,456,792 | https://dx.doi.org/10.1021/acsmedchemlett.7b00374 | 7j; IK-698 | 26/02/2021 | Charlton 2018 ACS Med. Chem. Lett. 9:84 | Curated Data | 64 | MIC | Test article | 237 | eq | 237 | 3.625252 | 3.625252 | Visual | Acinetobacter baumannii | ATCC 19606 | CIP 70.34; DSM 6974; 2208; 81 | Yes | Wild type | null | null | MHBII | CLSI, broth microdilution | TKW | 08/02/2021 | 20/09/2020 | KVT | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-88918010 | CC(C)C[C@H](N)C(=O)NS(=O)(=O)c1ccccc1 | HBYIBLSAKVSPSZ-NSHDSACASA-N | c1ccccc1 | 270.103813 | 0.8649 | 89.26 | true | false | false |
SPK-0255287 | CCCCCCC[C@@H](O)CC(=O)N[C@H](CCN)C(=O)N[C@@H](CCN)C(=O)N[C@@H](CCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCN)C(=O)N[C@@H](CCN)C(=O)N[C@@H](CC(C)C)C(O)=O | null | 1 | SPK-0255287-001 | No Salt, free base or acid | PMID:28454673 - Cmpd : 2b | null | 28,454,673 | https://dx.doi.org/10.1016/j.bmcl.2017.04.027 | 2b | 11/02/2021 | Becker 2017 Bioorg. Med. Chem. Lett. 27:2407 | Curated Data | > 32.0 | MIC | Test article | > 30.1 | gt | 30.1 | 4.521434 | 3.521434 | Visual | Acinetobacter baumannii | ATCC 19606 | CIP 70.34; DSM 6974; 2208; 81 | Yes | Wild type | null | Water | MHB | Broth microdilution | TKW | 08/02/2021 | 16/11/2020 | KVT | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-16526780 | CCCCCCC[C@@H](O)CC(=O)N[C@H](CCN)C(=O)N[C@@H](CCN)C(=O)N[C@@H](CCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCN)C(=O)N[C@@H](CCN)C(=O)N[C@@H](CC(C)C)C(=O)O | DCWLVQGVKGOSRS-BSIKMTNPSA-N | c1ccccc1 | 1,061.696101 | -1.8602 | 420.43 | true | false | false |
SPK-0255286 | CCCCCCC[C@@H](O)CC(=O)N[C@H](CCN)C(=O)N[C@H]1CCNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCN)NC(=O)[C@H](CCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CCN)NC1=O | null | 1 | SPK-0255286-001 | No Salt, free base or acid | PMID:28454673 - Cmpd : Octapeptin C4 | null | 28,454,673 | https://dx.doi.org/10.1016/j.bmcl.2017.04.027 | Octapeptin C4 | 11/02/2021 | Becker 2017 Bioorg. Med. Chem. Lett. 27:2407 | Curated Data | 4 | MIC | Test article | 3.83 | eq | 3.83 | 5.416801 | 5.416801 | Visual | Acinetobacter baumannii | ATCC 19606 | CIP 70.34; DSM 6974; 2208; 81 | Yes | Wild type | null | Water | MHB | Broth microdilution | TKW | 08/02/2021 | 16/11/2020 | KVT | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-82765616 | CCCCCCC[C@@H](O)CC(=O)N[C@H](CCN)C(=O)N[C@H]1CCNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCN)NC(=O)[C@H](CCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CCN)NC1=O | CSZHCBAEEWWDDZ-SDCQBVLXSA-N | O=C1CCCNC(=O)CNC(=O)CNC(=O)CNC(=O)CNC(=O)[C@@H](Cc2ccccc2)NC(=O)CN1 | 1,043.685536 | -1.7737 | 386.21 | true | false | false |
SPK-0255266 | CC(C)(C)CC(=O)N1CCN(CC1)c1cc2n(cc(C(O)=O)c(=O)c2cc1F)C1CC1 | null | 1 | SPK-0255266-001 | No Salt, free base or acid | PMID:26101578 - Cmpd : 10 | null | 26,101,578 | https://dx.doi.org/10.1021/acsmedchemlett.5b00146 | 10 | 20/10/2020 | Ji 2015 ACS Med. Chem. Lett. 6:707 | Curated Data | 10.7 | MIC | Test article | 24.9 | eq | 24.9 | 4.603801 | 4.603801 | Visual | Acinetobacter baumannii | ATCC 17961 | CDC 7788 | Yes | Wild type | null | null | CAMHB | CLSI | TKW | 21/09/2020 | 07/09/2020 | null | Acinetobacter baumannii ATCC 17961 | Acinetobacter baumannii ATCC 17961 | SCB-78836314 | CC(C)(C)CC(=O)N1CCN(c2cc3c(cc2F)c(=O)c(C(=O)O)cn3C2CC2)CC1 | XXVQFNBYTCFFOV-UHFFFAOYSA-N | O=c1ccn(C2CC2)c2cc(N3CCNCC3)ccc12 | 429.206385 | 3.2585 | 82.85 | true | false | false |
SPK-0255264 | CC1=CC(=O)C(=C(C)C1=O)C(C)(C)CC(=O)N1CCN(CC1)c1cc2n(cc(C(O)=O)c(=O)c2cc1F)C1CC1 | null | 1 | SPK-0255264-001 | No Salt, free base or acid | PMID:26101578 - Cmpd : 8-Cip | null | 26,101,578 | https://dx.doi.org/10.1021/acsmedchemlett.5b00146 | 8-Cip | 20/10/2020 | Ji 2015 ACS Med. Chem. Lett. 6:707 | Curated Data | 0.214 | MIC | Test article | 0.389 | eq | 0.389 | 6.41005 | 6.41005 | Visual | Acinetobacter baumannii | ATCC 17961 | CDC 7788 | Yes | Wild type | null | null | CAMHB | CLSI | TKW | 21/09/2020 | 07/09/2020 | null | Acinetobacter baumannii ATCC 17961 | Acinetobacter baumannii ATCC 17961 | SCB-10862439 | CC1=CC(=O)C(C(C)(C)CC(=O)N2CCN(c3cc4c(cc3F)c(=O)c(C(=O)O)cn4C3CC3)CC2)=C(C)C1=O | GGZNABINTACXIH-UHFFFAOYSA-N | O=C1C=CC(=O)C(CCC(=O)N2CCN(c3ccc4c(=O)ccn(C5CC5)c4c3)CC2)=C1 | 549.227514 | 3.6532 | 116.99 | true | false | false |
SPK-0255262 | CC1=C(N)C(=O)C(=C(C)C1=O)C(C)(C)CC(=O)N1CCN(CC1)c1cc2n(cc(C(O)=O)c(=O)c2cc1F)C1CC1 | null | 1 | SPK-0255262-001 | No Salt, free base or acid | PMID:26101578 - Cmpd : 7-Cip | null | 26,101,578 | https://dx.doi.org/10.1021/acsmedchemlett.5b00146 | 7-Cip | 20/10/2020 | Ji 2015 ACS Med. Chem. Lett. 6:707 | Curated Data | 0.339 | MIC | Test article | 0.6 | eq | 0.6 | 6.221849 | 6.221849 | Visual | Acinetobacter baumannii | ATCC 17961 | CDC 7788 | Yes | Wild type | null | null | CAMHB | CLSI | TKW | 21/09/2020 | 07/09/2020 | null | Acinetobacter baumannii ATCC 17961 | Acinetobacter baumannii ATCC 17961 | SCB-45888106 | CC1=C(N)C(=O)C(C(C)(C)CC(=O)N2CCN(c3cc4c(cc3F)c(=O)c(C(=O)O)cn4C3CC3)CC2)=C(C)C1=O | UTXUMLHMDDSISB-UHFFFAOYSA-N | O=C1C=CC(=O)C(CCC(=O)N2CCN(c3ccc4c(=O)ccn(C5CC5)c4c3)CC2)=C1 | 564.238413 | 2.9396 | 143.01 | true | false | false |
SPK-0255260 | CC1=C(Br)C(=O)C(=C(C)C1=O)C(C)(C)CC(=O)N1CCN(CC1)c1cc2n(cc(C(O)=O)c(=O)c2cc1F)C1CC1 | null | 1 | SPK-0255260-001 | No Salt, free base or acid | PMID:26101578 - Cmpd : 5-Cip | null | 26,101,578 | https://dx.doi.org/10.1021/acsmedchemlett.5b00146 | 5-Cip | 20/10/2020 | Ji 2015 ACS Med. Chem. Lett. 6:707 | Curated Data | 0.49 | MIC | Test article | 0.78 | eq | 0.78 | 6.107905 | 6.107905 | Visual | Acinetobacter baumannii | ATCC 17961 | CDC 7788 | Yes | Wild type | null | null | CAMHB | CLSI | TKW | 21/09/2020 | 07/09/2020 | null | Acinetobacter baumannii ATCC 17961 | Acinetobacter baumannii ATCC 17961 | SCB-16834242 | CC1=C(Br)C(=O)C(C(C)(C)CC(=O)N2CCN(c3cc4c(cc3F)c(=O)c(C(=O)O)cn4C3CC3)CC2)=C(C)C1=O | HQSLMDSMOMTZGA-UHFFFAOYSA-N | O=C1C=CC(=O)C(CCC(=O)N2CCN(c3ccc4c(=O)ccn(C5CC5)c4c3)CC2)=C1 | 627.138026 | 4.3758 | 116.99 | true | false | false |
SPK-0244747 | CC1CCC2=C(C1)SC(NC(=O)C1=CC=C(Cl)C=C1)=C2C(O)=O | null | 1 | SPK-0244747-001 | No Salt, free base or acid | PMID:29735709 - Cmpd : 4 | null | 29,735,709 | https://doi.org/10.1073/pnas.1804670115 | 4 | 24/05/2020 | Zhang 2018 Proc. Natl. Acad. Sci. U.S.A. 115:6834 | Curated Data | 20 | MIC | Test article | 57.2 | eq | 57.2 | 4.242604 | 4.242604 | spectrophotometer -100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | LB | Broth microdilution | TKW | 30/04/2020 | 09/04/2020 | SPJ | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-46208564 | CC1CCc2c(sc(NC(=O)c3ccc(Cl)cc3)c2C(=O)O)C1 | IJIVRVVHHDLZKV-UHFFFAOYSA-N | O=C(Nc1cc2c(s1)CCCC2)c1ccccc1 | 349.053942 | 4.4768 | 66.4 | true | false | false |
SPK-0244746 | CC(C)(C)C1CCC2=C(C1)SC(NC(=O)C1=CC=C(Cl)C=C1)=C2C(O)=O | null | 1 | SPK-0244746-001 | No Salt, free base or acid | PMID:29735709 - Cmpd : 3 | null | 29,735,709 | https://doi.org/10.1073/pnas.1804670115 | 3 | 24/05/2020 | Zhang 2018 Proc. Natl. Acad. Sci. U.S.A. 115:6834 | Curated Data | > 100 | MIC | Test article | > 255 | gt | 255 | 3.59346 | 2.59346 | spectrophotometer -100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | LB | Broth microdilution | TKW | 30/04/2020 | 09/04/2020 | SPJ | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-11396401 | CC(C)(C)C1CCc2c(sc(NC(=O)c3ccc(Cl)cc3)c2C(=O)O)C1 | KGKJEASNJPLRRQ-UHFFFAOYSA-N | O=C(Nc1cc2c(s1)CCCC2)c1ccccc1 | 391.100892 | 5.503 | 66.4 | true | false | false |
SPK-0244745 | CCOC(=O)C1=C(NC(=O)C2=CC=C(Cl)C=C2)SC2=C1CCCC2 | null | 1 | SPK-0244745-001 | No Salt, free base or acid | PMID:29735709 - Cmpd : 2 | null | 29,735,709 | https://doi.org/10.1073/pnas.1804670115 | 2 | 24/05/2020 | Zhang 2018 Proc. Natl. Acad. Sci. U.S.A. 115:6834 | Curated Data | > 100 | MIC | Test article | > 275 | gt | 275 | 3.560667 | 2.560667 | spectrophotometer -100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | LB | Broth microdilution | TKW | 30/04/2020 | 09/04/2020 | SPJ | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-68230007 | CCOC(=O)c1c(NC(=O)c2ccc(Cl)cc2)sc2c1CCCC2 | VEBJXARNPPZDKS-UHFFFAOYSA-N | O=C(Nc1cc2c(s1)CCCC2)c1ccccc1 | 363.069592 | 4.7093 | 55.4 | true | false | false |
SPK-0244744 | OC(=O)C1=C(NC(=O)C2=CC=C(Cl)C=C2)SC2=C1CCCC2 | null | 1 | SPK-0244744-001 | No Salt, free base or acid | PMID:29735709 - Cmpd : 1 | null | 29,735,709 | https://doi.org/10.1073/pnas.1804670115 | 1 | 24/05/2020 | Zhang 2018 Proc. Natl. Acad. Sci. U.S.A. 115:6834 | Curated Data | 20 | MIC | Test article | 59.6 | eq | 59.6 | 4.224754 | 4.224754 | spectrophotometer -100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | LB | Broth microdilution | TKW | 30/04/2020 | 09/04/2020 | SPJ | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-75206511 | O=C(Nc1sc2c(c1C(=O)O)CCCC2)c1ccc(Cl)cc1 | DUJFDTGMUKWELI-UHFFFAOYSA-N | O=C(Nc1cc2c(s1)CCCC2)c1ccccc1 | 335.038292 | 4.2308 | 66.4 | true | false | false |
SPK-0131276 | CC(CNC(=O)[C@H](O)C(C)(C)CO)C(=O)NCCC1=CC=CC=C1 | null | 1 | SPK-0131276-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 32.0 | Median | Test article | > 95.1 | gt | 95.1 | 4.021819 | 3.021819 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-48799522 | CC(CNC(=O)[C@H](O)C(C)(C)CO)C(=O)NCCc1ccccc1 | UUZRGTGCLRBVSX-WUJWULDRSA-N | c1ccccc1 | 336.204907 | 0.477 | 98.66 | true | false | false |
SPK-0131275 | CCCCCCCNC(=O)CCNC(=O)C(O)C(C)(C)CN | null | 1 | SPK-0131275-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 32.0 | Median | Test article | > 101 | gt | 101 | 3.995679 | 2.995679 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-71788488 | CCCCCCCNC(=O)CCNC(=O)C(O)C(C)(C)CN | BBLOQPBDUPWSER-UHFFFAOYSA-N | null | 315.252192 | 0.9251 | 104.45 | true | false | false |
SPK-0131274 | CC(C)(CO)[C@@H](O)C(=O)NCCC(=O)NCCC1=CC=CC=C1 | null | 1 | SPK-0131274-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 32.0 | Median | Test article | > 99.3 | gt | 99.3 | 4.003051 | 3.003051 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-44717712 | CC(C)(CO)[C@@H](O)C(=O)NCCC(=O)NCCc1ccccc1 | JZQDODPYLJNGAI-HNNXBMFYSA-N | c1ccccc1 | 322.189257 | 0.231 | 98.66 | true | false | false |
SPK-0131271 | CCCCCCCN(C)C(=O)CCNC(=O)[C@H](O)C(C)(C)CO | null | 1 | SPK-0131271-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 32.0 | Median | Test article | > 96.8 | gt | 96.8 | 4.014125 | 3.014125 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-79348892 | CCCCCCCN(C)C(=O)CCNC(=O)[C@H](O)C(C)(C)CO | GLMWJBAVGBAYTC-HNNXBMFYSA-N | null | 330.251858 | 1.3009 | 89.87 | true | false | false |
SPK-0131270 | CCCCCCCNC(=O)\C=C\NC(=O)[C@H](O)C(C)(C)CO | null | 1 | SPK-0131270-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 32.0 | Median | Test article | > 102 | gt | 102 | 3.9914 | 2.9914 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-22340484 | CCCCCCCNC(=O)/C=C/NC(=O)[C@H](O)C(C)(C)CO | SLHXGONBAPXSLS-AWEZNQCLSA-N | null | 314.220557 | 1.0823 | 98.66 | true | false | false |
SPK-0131267 | NCc1cccc(c1)-c1nccs1 | null | 1 | SPK-0131267-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 57.1 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-90205671 | NCc1cccc(-c2nccs2)c1 | UGCRMJJXRCJZHJ-UHFFFAOYSA-N | c1ccc(-c2nccs2)cc1 | 190.056469 | 2.2688 | 38.91 | true | false | false |
SPK-0131257 | CN(CCOc1ccc(Cl)cc1)C(=O)C(C)(C)CN | null | 1 | SPK-0131257-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 85.4 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-23185610 | CN(CCOc1ccc(Cl)cc1)C(=O)C(C)(C)CN | SITOFIHYXIJBBS-UHFFFAOYSA-N | c1ccccc1 | 284.129156 | 2.1621 | 55.56 | true | false | false |
SPK-0131255 | CS(=O)(=O)c1ccc(CN)o1 | null | 1 | SPK-0131255-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 52.6 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-99447983 | CS(=O)(=O)c1ccc(CN)o1 | BXMHHPDUTMFPMC-UHFFFAOYSA-N | c1ccoc1 | 175.030314 | 0.1418 | 73.3 | true | false | false |
SPK-0131249 | NCC(O)c1ccc(cc1)-c1ccccc1 | null | 1 | SPK-0131249-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 64.0 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-62507122 | NCC(O)c1ccc(-c2ccccc2)cc1 | ATTHACCWLCOMAC-UHFFFAOYSA-N | c1ccc(-c2ccccc2)cc1 | 213.115364 | 2.3457 | 46.25 | true | false | false |
SPK-0131248 | NCCNc1ccc2ccccc2n1 | null | 1 | SPK-0131248-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 56.2 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-10294350 | NCCNc1ccc2ccccc2n1 | ZETBPZAUNUEYSV-UHFFFAOYSA-N | c1ccc2ncccc2c1 | 187.110947 | 1.6054 | 50.94 | true | false | false |
SPK-0131247 | NCCC(=O)N1CCCC(CCc2ccc(F)cc2)C1 | null | 1 | SPK-0131247-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 83.5 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-25494765 | NCCC(=O)N1CCCC(CCc2ccc(F)cc2)C1 | DLZUHPLDWDXEEZ-UHFFFAOYSA-N | c1ccc(CCC2CCCNC2)cc1 | 278.179442 | 2.3457 | 46.33 | true | false | false |
SPK-0131245 | CC(C)(N)CN1CCN(CC1)c1cccc(Cl)c1 | null | 1 | SPK-0131245-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 80.3 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-11142282 | CC(C)(N)CN1CCN(c2cccc(Cl)c2)CC1 | LVWYYMVLJDHFER-UHFFFAOYSA-N | c1ccc(N2CCNCC2)cc1 | 267.150225 | 2.1993 | 32.5 | true | false | false |
SPK-0131242 | OCC(O)CNc1ccnc2ccc(Br)cc12 | null | 1 | SPK-0131242-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 89.1 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-85151457 | OCC(O)CNc1ccnc2ccc(Br)cc12 | ZKYJOODGENHSJE-UHFFFAOYSA-N | c1ccc2ncccc2c1 | 296.01604 | 1.7624 | 65.38 | true | false | false |
SPK-0131241 | CC(C)(N)C(O)c1ccc(Br)cc1 | null | 1 | SPK-0131241-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 73.2 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-43368440 | CC(C)(N)C(O)c1ccc(Br)cc1 | PYQYNZYWOPUGGQ-UHFFFAOYSA-N | c1ccccc1 | 243.025876 | 2.2198 | 46.25 | true | false | false |
SPK-0131236 | OCCNCCNCc1ccc(o1)-c1ccccc1Cl | null | 1 | SPK-0131236-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 88.4 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-10830412 | OCCNCCNCc1ccc(-c2ccccc2Cl)o1 | UDYOZVAPVVBKKD-UHFFFAOYSA-N | c1ccc(-c2ccco2)cc1 | 294.113506 | 2.2715 | 57.43 | true | false | false |
SPK-0131232 | CCCSc1ccc(NC(=O)NCCN)cc1 | null | 1 | SPK-0131232-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 76.0 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-29944237 | CCCSc1ccc(NC(=O)NCCN)cc1 | OJQYNYHDQTVBIG-UHFFFAOYSA-N | c1ccccc1 | 253.124883 | 2.2689 | 67.15 | true | false | false |
SPK-0131226 | COc1ccc(c(OC)c1)-c1ccnc(CO)c1 | null | 1 | SPK-0131226-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 73.6 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-51885625 | COc1ccc(-c2ccnc(CO)c2)c(OC)c1 | NJUNLWHKWVVIME-UHFFFAOYSA-N | c1ccc(-c2ccncc2)cc1 | 245.105193 | 2.2581 | 51.58 | true | false | false |
SPK-0131223 | CC(C)C(=O)c1cnccc1N | null | 1 | SPK-0131223-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 49.3 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-33249466 | CC(C)C(=O)c1cnccc1N | YWRCDZKEGISYMG-UHFFFAOYSA-N | c1ccncc1 | 164.094963 | 1.5025 | 55.98 | true | false | false |
SPK-0131219 | CN(C)CCC(=O)c1ccc(F)cc1 | null | 1 | SPK-0131219-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 58.6 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-71337647 | CN(C)CCC(=O)c1ccc(F)cc1 | XYMOGNZVKMQGSM-UHFFFAOYSA-N | c1ccccc1 | 195.105942 | 1.9601 | 20.31 | true | false | false |
SPK-0131218 | NCC(CO)Cc1ccc(Br)cc1 | null | 1 | SPK-0131218-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 73.2 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-70680535 | NCC(CO)Cc1ccc(Br)cc1 | FOIRXKAFHQNPSS-UHFFFAOYSA-N | c1ccccc1 | 243.025876 | 1.5588 | 46.25 | true | false | false |
SPK-0131212 | NCC(O)c1ccc(Cl)c(Cl)c1 | null | 1 | SPK-0131212-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 61.8 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-88966078 | NCC(O)c1ccc(Cl)c(Cl)c1 | KAFHLYIMFOUYGL-UHFFFAOYSA-N | c1ccccc1 | 205.006119 | 1.9855 | 46.25 | true | false | false |
SPK-0131211 | NS(=O)(=O)NCCCc1ccc(Br)cc1F | null | 1 | SPK-0131211-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 93.4 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-69286229 | NS(=O)(=O)NCCCc1ccc(Br)cc1F | ARPNGKWYAZYKMP-UHFFFAOYSA-N | c1ccccc1 | 309.978689 | 1.3139 | 72.19 | true | false | false |
SPK-0131209 | CCCOc1ccc(CN)cc1 | null | 1 | SPK-0131209-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 49.6 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-38021411 | CCCOc1ccc(CN)cc1 | RBILQKHLZVEMQD-UHFFFAOYSA-N | c1ccccc1 | 165.115364 | 1.9341 | 35.25 | true | false | false |
SPK-0131207 | CNc1nnc(s1)-c1ccccc1 | null | 1 | SPK-0131207-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 57.4 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-84913367 | CNc1nnc(-c2ccccc2)s1 | KYFFHIGZVFHJIV-UHFFFAOYSA-N | c1ccc(-c2nncs2)cc1 | 191.051718 | 2.2468 | 37.81 | true | false | false |
SPK-0131206 | NCc1nc(c[nH]1)-c1ccc(Cl)cc1 | null | 1 | SPK-0131206-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 62.3 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-39209329 | NCc1nc(-c2ccc(Cl)cc2)c[nH]1 | RDOJFKMPPSAZGC-UHFFFAOYSA-N | c1ccc(-c2c[nH]cn2)cc1 | 207.056325 | 2.1888 | 54.7 | true | false | false |
SPK-0131201 | CC(CN)N(C)C(=O)Cc1cccc2ccccc12 | null | 1 | SPK-0131201-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 76.9 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-47358925 | CC(CN)N(C)C(=O)Cc1cccc2ccccc12 | XNXWXGFHUPIXNF-UHFFFAOYSA-N | c1ccc2ccccc2c1 | 256.157563 | 2.1879 | 46.33 | true | false | false |
SPK-0131198 | CCCCCCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(O)(O)=O | null | 1 | SPK-0131198-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 32.0 | Median | Test article | > 80.7 | gt | 80.7 | 4.093126 | 3.093126 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-61583200 | CCCCCCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)(O)O | QTSWMJJVYAHWSJ-AWEZNQCLSA-N | null | 396.202538 | 1.0757 | 145.19 | true | false | false |
SPK-0131192 | CNC(CO)c1cccc(Cl)c1Cl | null | 1 | SPK-0131192-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 66.0 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-57270602 | CNC(CO)c1cccc(Cl)c1Cl | JISNQROLVLKLTG-UHFFFAOYSA-N | c1ccccc1 | 219.021769 | 2.2462 | 32.26 | true | false | false |
SPK-0131190 | NCC(=O)N1CCCC(CCc2ccc(F)cc2)C1 | null | 1 | SPK-0131190-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 79.3 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-45877013 | NCC(=O)N1CCCC(CCc2ccc(F)cc2)C1 | JHWQRWIWEIUTPK-UHFFFAOYSA-N | c1ccc(CCC2CCCNC2)cc1 | 264.163792 | 1.9556 | 46.33 | true | false | false |
SPK-0131187 | C[C@@H](N)C(=O)NCc1cc2cc(Cl)ccc2[nH]1 | null | 1 | SPK-0131187-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 75.5 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-11277280 | C[C@@H](N)C(=O)NCc1cc2cc(Cl)ccc2[nH]1 | RPCQHQZNPFUVHR-SSDOTTSWSA-N | c1ccc2[nH]ccc2c1 | 251.08254 | 1.7847 | 70.91 | true | false | false |
SPK-0131181 | FC(F)Oc1cccc(c1)N1CCNCC1 | null | 1 | SPK-0131181-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 68.5 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-49922268 | FC(F)Oc1cccc(N2CCNCC2)c1 | BYCOSSYLDOXDNE-UHFFFAOYSA-N | c1ccc(N2CCNCC2)cc1 | 228.10742 | 1.6976 | 24.5 | true | false | false |
SPK-0131179 | CNC(=O)CCCNC(=O)Nc1nc2ccccc2s1 | null | 1 | SPK-0131179-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 87.7 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-28561443 | CNC(=O)CCCNC(=O)Nc1nc2ccccc2s1 | DPJRLJIKZNLVPF-UHFFFAOYSA-N | c1ccc2scnc2c1 | 292.099397 | 1.944 | 83.12 | true | false | false |
SPK-0131177 | NCc1cnn(c1)-c1ccc(Br)cc1 | null | 1 | SPK-0131177-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 75.6 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-62273837 | NCc1cnn(-c2ccc(Br)cc2)c1 | JVUHAOWNRUMQKI-UHFFFAOYSA-N | c1ccc(-n2cccn2)cc1 | 251.005809 | 2.0935 | 43.84 | true | false | false |
SPK-0131176 | CN(C)C(=O)CNC(=O)NCc1cc(F)ccc1Br | null | 1 | SPK-0131176-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 99.7 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-14755273 | CN(C)C(=O)CNC(=O)NCc1cc(F)ccc1Br | YBEGPWRIRWODOS-UHFFFAOYSA-N | c1ccccc1 | 331.033167 | 1.4756 | 61.44 | true | false | false |
SPK-0131175 | CN(C)C(=O)CCNc1ccnc2ccc(Cl)cc12 | null | 1 | SPK-0131175-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 83.3 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-80840198 | CN(C)C(=O)CCNc1ccnc2ccc(Cl)cc12 | PVKGXEHPSIUWKP-UHFFFAOYSA-N | c1ccc2ncccc2c1 | 277.09819 | 2.7784 | 45.23 | true | false | false |
SPK-0131174 | OCCNCCNCc1ccc(o1)-c1cccc(Cl)c1 | null | 1 | SPK-0131174-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 88.4 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-10545649 | OCCNCCNCc1ccc(-c2cccc(Cl)c2)o1 | XFKFVJPWZGYMSM-UHFFFAOYSA-N | c1ccc(-c2ccco2)cc1 | 294.113506 | 2.2715 | 57.43 | true | false | false |
SPK-0131172 | CC(Sc1n[nH]c(n1)-c1ccccn1)C(=O)N(C)C | null | 1 | SPK-0131172-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 83.2 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-65087860 | CC(Sc1n[nH]c(-c2ccccn2)n1)C(=O)N(C)C | ZBSHBATUOWPPNO-UHFFFAOYSA-N | c1ccc(-c2ncn[nH]2)nc1 | 277.099731 | 1.4355 | 74.77 | true | false | false |
SPK-0131170 | CC(N)c1nc(c[nH]1)-c1ccc(Br)cc1 | null | 1 | SPK-0131170-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 79.8 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-98162225 | CC(N)c1nc(-c2ccc(Br)cc2)c[nH]1 | BBVLMJNZGIDONQ-UHFFFAOYSA-N | c1ccc(-c2c[nH]cn2)cc1 | 265.021459 | 2.8589 | 54.7 | true | false | false |
SPK-0131169 | CCNCCOc1cccc(OCC)c1 | null | 1 | SPK-0131169-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 62.8 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-79906385 | CCNCCOc1cccc(OCC)c1 | GSEOCEUABOZUPC-UHFFFAOYSA-N | c1ccccc1 | 209.141579 | 2.0736 | 30.49 | true | false | false |
SPK-0131166 | COc1ccc(F)c(c1)N1CCNCC1 | null | 1 | SPK-0131166-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 63.1 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-10540854 | COc1ccc(F)c(N2CCNCC2)c1 | CMYIPUCTRFIJOB-UHFFFAOYSA-N | c1ccc(N2CCNCC2)cc1 | 210.116841 | 1.2439 | 24.5 | true | false | false |
SPK-0131165 | NCCNS(=O)(=O)c1ccc(cc1)-c1ccccc1 | null | 1 | SPK-0131165-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 82.9 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-99159929 | NCCNS(=O)(=O)c1ccc(-c2ccccc2)cc1 | DLWLTTMLXUEPPR-UHFFFAOYSA-N | c1ccc(-c2ccccc2)cc1 | 276.093249 | 1.5906 | 72.19 | true | false | false |
SPK-0131163 | CCOC(=O)C(CN)CC(C)C | null | 1 | SPK-0131163-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 52.0 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-71634247 | CCOC(=O)C(CN)CC(C)C | UMVDNWOVACQNFP-UHFFFAOYSA-N | null | 173.141579 | 1.1705 | 52.32 | true | false | false |
SPK-0131160 | CN(C(=O)CN)c1ccc(cc1)-c1ccccc1 | null | 1 | SPK-0131160-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 72.1 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-67572750 | CN(C(=O)CN)c1ccc(-c2ccccc2)cc1 | CQPWSNARIKQZGP-UHFFFAOYSA-N | c1ccc(-c2ccccc2)cc1 | 240.126263 | 2.2751 | 46.33 | true | false | false |
SPK-0131155 | NCCc1cccc2cc[nH]c12 | null | 1 | SPK-0131155-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 48.1 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-21279134 | NCCc1cccc2cc[nH]c12 | JRWUXZQPAULKLR-UHFFFAOYSA-N | c1ccc2[nH]ccc2c1 | 160.100048 | 1.6691 | 41.81 | true | false | false |
SPK-0131153 | COC(CN)CC(C)C | null | 1 | SPK-0131153-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 39.4 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-36191711 | COC(CN)CC(C)C | JYUKUOAPGLIOTL-UHFFFAOYSA-N | null | 131.131014 | 1.0062 | 35.25 | true | false | false |
SPK-0131152 | CCOc1ncc(cc1Cl)C(=O)NCC(C)(O)C(C)C | null | 1 | SPK-0131152-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 90.2 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-27013219 | CCOc1ncc(C(=O)NCC(C)(O)C(C)C)cc1Cl | ROOFKXCTUOBUMV-UHFFFAOYSA-N | c1ccncc1 | 300.12407 | 2.2705 | 71.45 | true | false | false |
SPK-0131150 | COc1cccc(c1)-c1ncc(CN)s1 | null | 1 | SPK-0131150-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 66.1 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-10160491 | COc1cccc(-c2ncc(CN)s2)c1 | KXXKCTCCCGUWRW-UHFFFAOYSA-N | c1ccc(-c2nccs2)cc1 | 220.067034 | 2.2774 | 48.14 | true | false | false |
SPK-0131149 | CC(O)CN1C(=O)C=CC1=O | null | 1 | SPK-0131149-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 46.5 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-82113084 | CC(O)CN1C(=O)C=CC1=O | YWFOKXPDJMYPQR-UHFFFAOYSA-N | O=C1C=CC(=O)N1 | 155.058243 | -0.7078 | 57.61 | true | false | false |
SPK-0131147 | OCCNC(=O)Nc1nc2ccccc2s1 | null | 1 | SPK-0131147-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 71.2 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-19016760 | O=C(NCCO)Nc1nc2ccccc2s1 | QTJAAOWDCCXJAR-UHFFFAOYSA-N | c1ccc2scnc2c1 | 237.057198 | 1.4101 | 74.25 | true | false | false |
SPK-0131145 | NCc1cnn(c1)-c1cccc(Cl)c1 | null | 1 | SPK-0131145-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 62.3 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-10575190 | NCc1cnn(-c2cccc(Cl)c2)c1 | FROXYDQDKDAPOK-UHFFFAOYSA-N | c1ccc(-n2cccn2)cc1 | 207.056325 | 1.9844 | 43.84 | true | false | false |
SPK-0131144 | COCC(O)CNc1c(C)c(C)nc2ccccc12 | null | 1 | SPK-0131144-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 78.1 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-88077379 | COCC(O)CNc1c(C)c(C)nc2ccccc12 | GYYGASNWBGGGJX-UHFFFAOYSA-N | c1ccc2ncccc2c1 | 260.152478 | 2.27084 | 54.38 | true | false | false |
SPK-0131138 | NCC(=O)N1CCCC(CCc2ccc(F)cc2F)C1 | null | 1 | SPK-0131138-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 84.7 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-71307060 | NCC(=O)N1CCCC(CCc2ccc(F)cc2F)C1 | RYQNIWSFEQFKOO-UHFFFAOYSA-N | c1ccc(CCC2CCCNC2)cc1 | 282.15437 | 2.0947 | 46.33 | true | false | false |
SPK-0131137 | CC(CSc1n[nH]c(n1)-c1ccccn1)CS(C)(=O)=O | null | 1 | SPK-0131137-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 93.7 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-10616712 | CC(CSc1n[nH]c(-c2ccccn2)n1)CS(C)(=O)=O | FQIXTGPVOWPFDZ-UHFFFAOYSA-N | c1ccc(-c2ncn[nH]2)nc1 | 312.071468 | 1.6395 | 88.6 | true | false | false |
SPK-0131133 | NCC(=O)N1CCCC(CCc2ccc(F)c(F)c2)C1 | null | 1 | SPK-0131133-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 84.7 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-31891139 | NCC(=O)N1CCCC(CCc2ccc(F)c(F)c2)C1 | LOCQFEWFQVYBIO-UHFFFAOYSA-N | c1ccc(CCC2CCCNC2)cc1 | 282.15437 | 2.0947 | 46.33 | true | false | false |
SPK-0131127 | CCS(=O)(=O)NCC(N)c1ccc(cc1)C(C)C | null | 1 | SPK-0131127-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 81.1 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-39230780 | CCS(=O)(=O)NCC(N)c1ccc(C(C)C)cc1 | FPKJWGOPIXRKGQ-UHFFFAOYSA-N | c1ccccc1 | 270.140199 | 1.7491 | 72.19 | true | false | false |
SPK-0131126 | Cn1c(CN)nc2cc(Cl)ccc12 | null | 1 | SPK-0131126-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 58.7 | Median | Test article | > 300 | gt | 300 | 3.522879 | 2.522879 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-65596541 | Cn1c(CN)nc2cc(Cl)ccc21 | SPLIVFYNGMDOBZ-UHFFFAOYSA-N | c1ccc2[nH]cnc2c1 | 195.056325 | 1.6854 | 43.84 | true | false | false |
SPK-0131123 | CCCCCCCNC(=O)CC(C)NC(=O)[C@H](O)C(C)(C)CO | null | 1 | SPK-0131123-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 32.0 | Median | Test article | > 96.8 | gt | 96.8 | 4.014125 | 3.014125 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-88300654 | CCCCCCCNC(=O)CC(C)NC(=O)[C@H](O)C(C)(C)CO | HUZOJBWWYRXCAG-WUJWULDRSA-N | null | 330.251858 | 1.3472 | 98.66 | true | false | false |
SPK-0131122 | CCCCCCCNC(=O)C(C)CNC(=O)[C@H](O)C(C)(C)CO | null | 1 | SPK-0131122-001 | No Salt, free base or acid | null | null | null | null | null | 28/01/2020 | CO-ADD | Curated Data | > 32.0 | Median | Test article | > 96.8 | gt | 96.8 | 4.014125 | 3.014125 | spectrophotometer < 100% | Acinetobacter baumannii | ATCC 19606 | CIP 70.34 | No | Wild type | null | null | CAMHB | null | MN, RJT | 27/01/2020 | null | null | Acinetobacter baumannii ATCC 19606 | Acinetobacter baumannii ATCC 19606 | SCB-16716268 | CCCCCCCNC(=O)C(C)CNC(=O)[C@H](O)C(C)(C)CO | MHFUESOIBOIIMJ-KZUDCZAMSA-N | null | 330.251858 | 1.2047 | 98.66 | true | false | false |
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