smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
[O-]c1cccc([C@H](Nc2ccccn2)c2ccc3cccnc3c2[O-])c1Cl	ZINC000002502842	209368144	/nfs/dbraw/zinc/36/81/44/209368144.db2.gz	KITWISGNBVVYDE-FQEVSTJZSA-N	-2	3	377.831	4.896	10	10	aggregator	GJCEHL
CC(C)=CCc1cc2c(=O)c3c(O)c(CC=C(C)C)c([O-])cc3oc2c(O)c1[O-]	ZINC000014727613	570923357	/nfs/dbraw/zinc/92/33/57/570923357.db2.gz	HYEUTPGCGSJHQC-UHFFFAOYSA-N	-2	3	396.439	4.786	10	10	biogenic	GJCEHL
[O-]c1cccc([C@@H](Nc2ccccn2)c2ccc3cccnc3c2[O-])c1Cl	ZINC000002502843	570289005	/nfs/dbraw/zinc/28/90/05/570289005.db2.gz	KITWISGNBVVYDE-HXUWFJFHSA-N	-2	3	377.831	4.896	10	10	aggregator	GJCEHL