smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCN(CC)c1ccc(/C=N/c2ccc([N+](=O)[O-])cc2[O-])c([O-])c1	ZINC000004991891	210352873	/nfs/dbraw/zinc/35/28/73/210352873.db2.gz	GQZVLKBBXXKKEK-WOJGMQOQSA-N	-2	3	329.356	3.603	10	30		EHEEHL
O=[N+]([O-])c1ccc([O-])c(/N=C\c2cc(Br)ccc2[O-])c1	ZINC000020458966	212133090	/nfs/dbraw/zinc/13/30/90/212133090.db2.gz	SUBBKZMSBSBDLO-CHHVJCJISA-N	-2	3	337.129	3.519	10	30		EHEEHL
CC(C)=CCc1c([O-])ccc(C(=O)/C=C/c2ccc(O)c(O)c2)c1[O-]	ZINC000014762500	519443943	/nfs/dbraw/zinc/44/39/43/519443943.db2.gz	ISKWCIVFBIHFTG-XBXARRHUSA-N	-2	3	340.375	3.914	10	30	biogenic	EHEEHL
CC(C)=CCc1c(O)cc([O-])c(C(=O)/C=C/c2ccc(O)cc2)c1[O-]	ZINC000005158935	563995562	/nfs/dbraw/zinc/99/55/62/563995562.db2.gz	FUSADYLVRMROPL-UXBLZVDNSA-N	-2	3	340.375	3.914	10	30	endogenous,in-man	EHEEHL