smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN1CCN(C(=O)C[C@H](NC(=O)C=Cc2cc(Cl)ccc2-n2cnnn2)c2nc(Cl)c(-c3ccc4[nH]c(=O)cc([O-])c4c3)[nH]2)CC1	ZINC000217356091	562877537	/nfs/dbraw/zinc/87/75/37/562877537.db2.gz	NBMJTOOHXJGJNZ-RJOTYRNVSA-N	-1	0	663.526	2.941	1	70	in-vitro	KFIFRM
Cc1n[nH]c(C)c1CC1(O)CCN(C(=O)c2ccc([N-]S(=O)(=O)c3cccc4nccnc43)cc2)CC1	ZINC000217759517	562877690	/nfs/dbraw/zinc/87/76/90/562877690.db2.gz	VEUIINWORDJVSC-UHFFFAOYSA-N	-1	0	520.615	2.980	1	70		KFIFRM
O=C(c1ccc([N-]S(=O)(=O)c2cccc3nccnc32)cc1)N1CCC(O)(C2CCC(O)CC2)CC1	ZINC000217800650	562877787	/nfs/dbraw/zinc/87/77/87/562877787.db2.gz	HQPSZLVMTBFBPN-UHFFFAOYSA-N	-1	0	510.616	2.949	1	70		KFIFRM