smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCOC(=O)c1c(C)c(C(=O)OC)sc1[N-]N=C1C(=O)[N-]C(=O)NC1=O	ZINC000001788279	570424688	/nfs/dbraw/zinc/42/46/88/570424688.db2.gz	IFOJHWFVKNFQLZ-UHFFFAOYSA-N	-2	1	382.354	0.154	50	30		GCEAML
COc1cc(/C=N/N=C2\NC(=O)C(CC(=O)[O-])S2)ccc1OCC(=O)[O-]	ZINC000016115180	570914160	/nfs/dbraw/zinc/91/41/60/570914160.db2.gz	LORYFFNBQNGIFF-OHUUDMDPSA-N	-2	1	381.366	0.555	50	30		GCEAML
COc1cc(/C=N/N=C2\NC(=O)C(CC(=O)[O-])S2)ccc1OCC(=O)[O-]	ZINC000006603501	570484342	/nfs/dbraw/zinc/48/43/42/570484342.db2.gz	LORYFFNBQNGIFF-MTTUFYGSSA-N	-2	1	381.366	0.555	50	30		GCEAML
C=CCc1cc(C=C2C(=O)[N-]C(=S)NC2=O)cc(OC)c1OCC(=O)[O-]	ZINC000002313779	206249816	/nfs/dbraw/zinc/24/98/16/206249816.db2.gz	KJXBVPVAFADUSR-UHFFFAOYSA-N	-2	1	376.390	0.801	50	30		GCEAML
O=C([O-])c1ccccc1[N-]S(=O)(=O)c1ccc(NC(=O)C(=O)NO)cc1	ZINC000001884569	212259436	/nfs/dbraw/zinc/25/94/36/212259436.db2.gz	XVCKEHORAULDIV-UHFFFAOYSA-N	-2	1	379.350	0.630	50	30		GCEAML