smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C1[C@H]2[C@H]3C=C[C@H](C3)[C@@H]2C(=O)N1/N=C/c1cc(Br)c([O-])cc1O	ZINC000005091996	204110996	/nfs/dbraw/zinc/11/09/96/204110996.db2.gz	POKZOMZXZUKMTB-YUAGWOBUSA-N	-1	1	377.194	2.001	10	30		GEEEMM
COc1cc(C=NNc2nc(C)cc(=O)[n-]2)ccc1OC(=O)c1cccnc1	ZINC000012566233	521994859	/nfs/dbraw/zinc/99/48/59/521994859.db2.gz	ATBWFZLYWKXDCY-UFFVCSGVSA-N	-1	1	379.376	2.147	10	30		GEEEMM
CC1=CC(=NNc2ccc(S(=O)(=O)[N-]c3ccccn3)cc2)C(N)=CC1=O	ZINC000583650541	570804210	/nfs/dbraw/zinc/80/42/10/570804210.db2.gz	BBJDRANVVNBXAR-UHFFFAOYSA-N	-1	1	383.433	2.022	10	30		GEEEMM
N#CC1(c2cccnc2)CCN(Cc2cc(C(=O)[O-])c(=O)n3ccccc23)CC1	ZINC000059262674	222055800	/nfs/dbraw/zinc/05/58/00/222055800.db2.gz	FIVQVYLRWKPDSR-UHFFFAOYSA-N	-1	1	388.427	2.450	10	30		GEEEMM
O=C1[C@@H]2[C@@H]3C=C[C@@H](C3)[C@@H]2C(=O)N1/N=C/c1cc(Br)c([O-])cc1O	ZINC000005091992	570428642	/nfs/dbraw/zinc/42/86/42/570428642.db2.gz	POKZOMZXZUKMTB-SAUCPJNHSA-N	-1	1	377.194	2.001	10	30		GEEEMM