smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C=CCN(CC=C)S(=O)(=O)c1ccc(-n2ncc(=O)[nH]c2=O)cc1Cl	ZINC000026022756	209175545	/nfs/dbraw/zinc/17/55/45/209175545.db2.gz	UATXQFJELVDUDN-UHFFFAOYSA-N	0	2	382.829	0.937	1	30		GCEFLN
C[C@H]1CO[C@@H]2C(C[NH+]3CCN(C)CC3)=C(F)C=C3C(=O)C(C(=O)[O-])=CN1[C@H]32	ZINC000052996741	205135315	/nfs/dbraw/zinc/13/53/15/205135315.db2.gz	QXPZFZNTFIOTEO-LIXBPZJASA-N	0	2	377.416	0.407	1	30		GCEFLN
CCCCNC(O)=NS(=O)(=O)c1ccc(OCc2no[n+]([O-])c2C#N)cc1	ZINC000095552249	222355070	/nfs/dbraw/zinc/35/50/70/222355070.db2.gz	KGVXFRUMAXEMKI-UHFFFAOYSA-N	0	2	395.397	0.751	1	30		GCEFLN
C=CCc1c(O)n(Cc2ccccc2)c2nc3c(c(=O)n(C)c(=O)n3C)n2c1=O	ZINC000034090845	212110820	/nfs/dbraw/zinc/11/08/20/212110820.db2.gz	REJNQCFXPWPCPK-UHFFFAOYSA-N	0	2	393.403	0.529	1	30		GCEFLN