smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN1CCC(Oc2ccc([N-]S(=O)(=O)c3ccc(Br)cc3)cc2)CC1	ZINC000216941211	557164374	/nfs/dbraw/zinc/16/43/74/557164374.db2.gz	LMJOVNHJJHJBOJ-UHFFFAOYSA-N	-1	3	425.348	3.723	40	70		IHIBHM
CN1CCC(Oc2ccc([N-]S(=O)(=O)c3ccc(Br)s3)cc2)CC1	ZINC000216938282	557163869	/nfs/dbraw/zinc/16/38/69/557163869.db2.gz	TYFQORZOPWJKDL-UHFFFAOYSA-N	-1	3	431.377	3.784	40	70		IHIBHM
Cc1ccc(C)c([N-]S(=O)(=O)c2cc(C(=O)NC3CCN(C)CC3)ccc2Cl)c1	ZINC000216940924	557164389	/nfs/dbraw/zinc/16/43/89/557164389.db2.gz	QYIWWMZXPCMJQM-UHFFFAOYSA-N	-1	3	435.977	3.582	40	70		IHIBHM
Cc1ccc([N-]S(=O)(=O)c2cc(C(=O)NC3CCN(C)CC3)ccc2Cl)cc1C	ZINC000216940951	557164327	/nfs/dbraw/zinc/16/43/27/557164327.db2.gz	BYQVFXULHOELDC-UHFFFAOYSA-N	-1	3	435.977	3.582	40	70		IHIBHM
Cc1ccc([N-]S(=O)(=O)c2cc(C(=O)NC3CCN(C)CC3)ccc2Cl)c(C)c1	ZINC000216940898	557164250	/nfs/dbraw/zinc/16/42/50/557164250.db2.gz	NOTRJUFOMVAHSP-UHFFFAOYSA-N	-1	3	435.977	3.582	40	70		IHIBHM