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-])c1cccc(N2C(=O)C(O)=C(C(=O)c3ccccc3)[C@H]2c2ccccc2)c1	ZINC000006424060	570411511	/nfs/dbraw/zinc/41/15/11/570411511.db2.gz	UEHNOJBYERIRME-YDJIHCHBSA-N	-2	0	399.402	4.011	50	30		GIEARL
O=C([O-])c1ccc(COc2ccccc2/C=N/c2ccc(O)c(C(=O)[O-])c2)cc1	ZINC000005636569	526368515	/nfs/dbraw/zinc/36/85/15/526368515.db2.gz	FMRWUUMYBBXKBD-FSJBWODESA-N	-2	0	391.379	4.118	50	30		GIEARL
CC(=O)[N-]S(=O)(=O)c1ccc(N=Cc2cc(Cl)cc(Cl)c2[O-])cc1	ZINC000017025347	518476398	/nfs/dbraw/zinc/47/63/98/518476398.db2.gz	GAISZMMQCBVPEY-QGMBQPNBSA-N	-2	0	387.244	4.115	50	30		GIEARL
C/C(=C\c1ccc(C(=O)[O-])cc1)C(=O)c1ccc(OCCCCC(=O)[O-])cc1	ZINC000065500633	570826713	/nfs/dbraw/zinc/82/67/13/570826713.db2.gz	LMXLINGYDQZGLO-CCEZHUSRSA-N	-2	0	382.412	4.305	50	30		GIEARL
O=C([O-])c1cccc(N2C(=O)C(O)=C(C(=O)c3ccccc3)[C@@H]2c2ccccc2)c1	ZINC000006424065	570411440	/nfs/dbraw/zinc/41/14/40/570411440.db2.gz	UEHNOJBYERIRME-NHFXJNLRSA-N	-2	0	399.402	4.011	50	30		GIEARL
CC(C)C(=O)NC(Nc1ccc(F)c(Cl)c1)(C(F)(F)F)C(F)(F)F	ZINC000003024810	570528417	/nfs/dbraw/zinc/52/84/17/570528417.db2.gz	JHBNPKDFJZTMFA-UHFFFAOYSA-N	-2	0	380.691	4.484	50	30		GIEARL