smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1ccc(S(=O)(=O)[N-]c2ccccc2C(=NNc2ccccc2)C(=O)[O-])cc1	ZINC000223813596	568559755	/nfs/dbraw/zinc/55/97/55/568559755.db2.gz	CHQLZZIOBGXJFU-ATJXCDBQSA-N	-2	1	409.467	3.697	40	30		HHEBML
O=C([O-])CCN1C2=C(C(=O)CCC2)C(c2ccc([O-])c(Cl)c2)C2=C1CCCC2=O	ZINC000409065803	560672272	/nfs/dbraw/zinc/67/22/72/560672272.db2.gz	NJHFELCKDVTMSV-UHFFFAOYSA-N	-2	1	415.873	3.934	40	30		HHEBML
O=[N+]([O-])c1ccc([O-])c(/C=N/c2ccccc2[N-]S(=O)(=O)Cc2ccccc2)c1	ZINC000005598884	557664622	/nfs/dbraw/zinc/66/46/22/557664622.db2.gz	QGGFZTZVQXDLBH-FYJGNVAPSA-N	-2	1	411.439	3.993	40	30		HHEBML
Cc1cc(CN=Nc2ccc([N+](=O)[O-])cc2)c(C)n1-c1cc(C(=O)[O-])cc(C(=O)[O-])c1	ZINC000059249854	568703404	/nfs/dbraw/zinc/70/34/04/568703404.db2.gz	XBZBMYVCHSIQSC-SSDVNMTOSA-N	-2	1	422.397	3.845	40	30		HHEBML