smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC1(C)NC(=[NH2+])NC(=N)N1c1ccc(CCCCc2cc(Cl)ccc2S(=O)(=O)F)c(Cl)c1	ZINC000043300328	562647390	/nfs/dbraw/zinc/64/73/90/562647390.db2.gz	LFXQJPLSGITUKM-UHFFFAOYSA-N	1	0	500.427	4.403	40	70		KIIBRO
CC1(C)NC(=[NH2+])NC(=N)N1c1ccc(CCCCc2ccc(Cl)cc2S(=O)(=O)F)c(Cl)c1	ZINC000043300435	562647428	/nfs/dbraw/zinc/64/74/28/562647428.db2.gz	CDBJTQNRWOHIBD-UHFFFAOYSA-N	1	0	500.427	4.403	40	70		KIIBRO
CC1(C)NC(=[NH2+])NC(=N)N1c1ccc(OCc2ccc(C(=O)Nc3cccc(S(=O)(=O)F)c3)cc2)c(Cl)c1	ZINC000043307573	562647577	/nfs/dbraw/zinc/64/75/77/562647577.db2.gz	XRLFNMNZWUJTLQ-UHFFFAOYSA-N	1	0	559.023	4.015	40	70		KIIBRO
CC1(C)NC(=[NH2+])NC(=N)N1c1ccc(CCCCc2ccc(S(=O)(=O)F)cc2Cl)c(Cl)c1	ZINC000043706278	562650823	/nfs/dbraw/zinc/65/08/23/562650823.db2.gz	MQTIONOODXSMIB-UHFFFAOYSA-N	1	0	500.427	4.403	40	70		KIIBRO
CC1(C)NC(=[NH2+])NC(=N)N1c1ccc(CCCCc2ccc(Cl)c(S(=O)(=O)F)c2)c(Cl)c1	ZINC000043860732	562651088	/nfs/dbraw/zinc/65/10/88/562651088.db2.gz	MUJBURJCNWOOJV-UHFFFAOYSA-N	1	0	500.427	4.403	40	70		KIIBRO
CC1(C)NC(=[NH2+])NC(=N)N1c1ccc(CCCCc2ccc(S(=O)(=O)F)c(Cl)c2)c(Cl)c1	ZINC000043871712	562651134	/nfs/dbraw/zinc/65/11/34/562651134.db2.gz	DLWNCBJHSVAOML-UHFFFAOYSA-N	1	0	500.427	4.403	40	70		KIIBRO
C[NH+]1CCC(NC(=O)CN(Cc2ccc(Cl)c(Cl)c2)S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000216799109	571597894	/nfs/dbraw/zinc/59/78/94/571597894.db2.gz	CZZSTXZUZUVIEB-UHFFFAOYSA-N	1	0	504.867	4.048	40	70		KIIBRO
C[NH+]1CCC(NC(=O)CN(Cc2c(Cl)cccc2Cl)S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000216803516	571598268	/nfs/dbraw/zinc/59/82/68/571598268.db2.gz	WMUFTDLBWRDRKU-UHFFFAOYSA-N	1	0	504.867	4.048	40	70		KIIBRO
C[NH+]1CCC(NC(=O)CN(Cc2ccc(Cl)cc2Cl)S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000216804983	571598222	/nfs/dbraw/zinc/59/82/22/571598222.db2.gz	JHBRBGOWLAXEJZ-UHFFFAOYSA-N	1	0	504.867	4.048	40	70		KIIBRO
C[NH+]1CCC(NC(=O)CN(Cc2ccc(Cl)c(Cl)c2)S(=O)(=O)c2ccc(Br)cc2)CC1	ZINC000216807660	571598585	/nfs/dbraw/zinc/59/85/85/571598585.db2.gz	WRZAJOSVISGQAD-UHFFFAOYSA-N	1	0	549.318	4.157	40	70		KIIBRO
C[NH+]1CCC(NC(=O)CN(Cc2ccc(Cl)cc2Cl)S(=O)(=O)c2ccc(Br)cc2)CC1	ZINC000216808001	571598561	/nfs/dbraw/zinc/59/85/61/571598561.db2.gz	SLSPHDNRMIETEX-UHFFFAOYSA-N	1	0	549.318	4.157	40	70		KIIBRO