smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1c(O)c(C[N@@H+]2CCC[C@@H]2c2nc(C(=O)[O-])c(C)s2)ccc1[N+](=O)[O-]	ZINC001599344079	997970438	/nfs/dbraw/zinc/97/04/38/997970438.db2.gz	AYFDZPOMJGATIQ-GFCCVEGCSA-N	-2	2	393.421	3.109	20	10		GGCDLL
COc1c(O)c(C[N@@H+]2CCC[C@H]2c2nc(C(=O)[O-])c(C)s2)ccc1[N+](=O)[O-]	ZINC001599344080	997970044	/nfs/dbraw/zinc/97/00/44/997970044.db2.gz	AYFDZPOMJGATIQ-LBPRGKRZSA-N	-2	2	393.421	3.109	20	10		GGCDLL
COc1cc(C(=O)[O-])ccc1S(=O)(=O)Nc1cc(Cl)c([O-])c(Cl)c1	ZINC000326168769	971271338	/nfs/dbraw/zinc/27/13/38/971271338.db2.gz	JNPYTGOLRKYMKM-UHFFFAOYSA-N	-2	2	392.216	3.207	20	10		GGCDLL
COc1ccc(C(=O)[O-])cc1S(=O)(=O)Nc1cc(Cl)c([O-])c(Cl)c1	ZINC000392425350	972483580	/nfs/dbraw/zinc/48/35/80/972483580.db2.gz	IATUVDQLBPDHFA-UHFFFAOYSA-N	-2	2	392.216	3.207	20	10		GGCDLL