smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C([O-])c1c(C(F)(F)F)[n-]sc1=NC(=O)OCC1c2ccccc2-c2ccccc21	ZINC000675076023	569161885	/nfs/dbraw/zinc/16/18/85/569161885.db2.gz	IQBNZKJSTLJVMI-UHFFFAOYSA-N	-2	0	434.395	5.221	10	0		IKAERL
CCCCCC=C(c1cc(Cl)c(O)c(C(=O)[O-])c1)c1cc(Cl)c(O)c(C(=O)[O-])c1	ZINC000001623083	562923243	/nfs/dbraw/zinc/92/32/43/562923243.db2.gz	YLZUMCVSEHJEGG-UHFFFAOYSA-N	-2	0	439.291	5.813	10	0		IKAERL
CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/COC[C@H](O)COP(=O)([O-])[O-]	ZINC000004096469	560194064	/nfs/dbraw/zinc/19/40/64/560194064.db2.gz	BJLPWUCPFAJINB-UAQSTNRTSA-N	-2	0	444.549	5.619	10	0	in-vitro	IKAERL
CC(C)(CCCOc1cc(Cl)c(OCCCC(C)(C)C(=O)[O-])cc1Cl)C(=O)[O-]	ZINC000025974601	563027772	/nfs/dbraw/zinc/02/77/72/563027772.db2.gz	DTDFPDNLFHBONN-UHFFFAOYSA-N	-2	0	435.344	5.533	10	0		IKAERL