smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C([O-])c1ccc(/C=C2\CN(c3cccc[nH+]3)C/C(=C/c3ccc(C(=O)[O-])cc3)C2=O)cc1	ZINC000097096866	526360811	/nfs/dbraw/zinc/36/08/11/526360811.db2.gz	BPNHSIDVWLUFCG-VOKWCDJLSA-N	-1	2	440.455	4.034	50	30		IIEALM
O=S(=O)(c1ccc([O-])c(/N=C/c2ccc[nH]2)c1)c1ccc(O)c(/N=C/c2ccc[nH]2)c1	ZINC000001232652	568759877	/nfs/dbraw/zinc/75/98/77/568759877.db2.gz	XAPUOLQWDAGEFZ-BKHCZYBLSA-N	-1	2	434.477	4.088	50	30		IIEALM
O=C(/C=C/c1ccc(Br)cc1)c1c(O)nc([O-])n(CCC2=CCCCC2)c1=O	ZINC000009235358	569514077	/nfs/dbraw/zinc/51/40/77/569514077.db2.gz	AOYAYWVTCBLSGN-DHZHZOJOSA-N	-1	2	445.313	4.204	50	30		IIEALM