smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1[n-]n(-c2ccc([N+](=O)[O-])cc2)c(=O)c1N=Nc1ccc(C(=O)[O-])cc1	ZINC000100149733	205940162	/nfs/dbraw/zinc/94/01/62/205940162.db2.gz	LRTHAIYDCLRQAA-XDJHFCHBSA-N	-2	0	367.321	2.484	10	30		FEEERL
C=C1C[C@]23C[C@H]1CC[C@H]2[C@]1(C=O)CC[C@H](O)[C@@](C)(C(=O)[O-])[C@H]1[C@@H]3C(=O)[O-]	ZINC000004102245	560196666	/nfs/dbraw/zinc/19/66/66/560196666.db2.gz	JZBLVVPDEDCVQA-SQLMURCQSA-N	-2	0	362.422	2.111	10	30	in-vitro	FEEERL
C=C1C[C@]23C[C@@]1(O)CC[C@H]2[C@]1(C=O)CCC[C@@](C)(C(=O)[O-])[C@H]1[C@@H]3C(=O)[O-]	ZINC000033913813	291047810	/nfs/dbraw/zinc/04/78/10/291047810.db2.gz	VNCQCPQAMDQEBY-YTJHIPEWSA-N	-2	0	362.422	2.255	10	30	biogenic,in-vitro	FEEERL
C=C1C[C@]23C[C@@]1(O)CC[C@H]2[C@]1(CO)CCC[C@@](C)(C(=O)[O-])[C@H]1[C@@H]3C(=O)[O-]	ZINC000004097025	560194406	/nfs/dbraw/zinc/19/44/06/560194406.db2.gz	AXEUUXHMKSPQAI-YTJHIPEWSA-N	-2	0	364.438	2.048	10	30	in-vitro	FEEERL
Cc1n[n-]c(=S)n(N=Cc2ccc(-c3ccc(C(=O)[O-])cc3)o2)c1=O	ZINC000215669509	548673009	/nfs/dbraw/zinc/67/30/09/548673009.db2.gz	KJEGGJJHMARYEP-CAOOACKPSA-N	-2	0	356.363	2.450	10	30		FEEERL