smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=S(=O)([O-])c1cc([O-])c(/N=C/c2c[nH]c3ccccc23)c2ccccc21	ZINC000040379633	205068052	/nfs/dbraw/zinc/06/80/52/205068052.db2.gz	BZUSNHPBKKLYPK-SRZZPIQSSA-N	-2	1	366.398	4.024	1	30		FIEFML
O=S(=O)([O-])c1cc([O-])c(/N=C/c2cccc(Cl)c2)c2ccccc21	ZINC000098082544	205935062	/nfs/dbraw/zinc/93/50/62/205935062.db2.gz	PZBFMQUNIVFDNT-VXLYETTFSA-N	-2	1	361.806	4.196	1	30		FIEFML
O=S(=O)([O-])c1cc([O-])c(/N=C/C=C/c2ccccc2)c2ccccc21	ZINC000098082542	222226826	/nfs/dbraw/zinc/22/68/26/222226826.db2.gz	LQDMBLDFPJKSTI-XCHVBMRISA-N	-2	1	353.399	4.208	1	30		FIEFML
CCCC1(CCC)C(=O)C(=C([O-])C(C)C)C(=O)C(=C([O-])C(C)C)C1=O	ZINC000100768559	222251614	/nfs/dbraw/zinc/25/16/14/222251614.db2.gz	OILWAPJBDWQZEZ-UHFFFAOYSA-N	-2	1	350.455	4.230	1	30		FIEFML