smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(=O)CC[C@H]1COc2cc3c(c([O-])c21)C(=O)c1c(O)cc([O-])cc1C3=O	ZINC000005159661	560201008	/nfs/dbraw/zinc/20/10/08/560201008.db2.gz	XDLBESHDJXFECS-VIFPVBQESA-N	-2	3	368.341	2.424	10	10	in-vitro	FECEHL
CC(=O)CC[C@@H]1COc2cc3c(c([O-])c21)C(=O)c1c(O)cc([O-])cc1C3=O	ZINC000005159635	560201002	/nfs/dbraw/zinc/20/10/02/560201002.db2.gz	XDLBESHDJXFECS-SECBINFHSA-N	-2	3	368.341	2.424	10	10	in-vitro	FECEHL
O=C1[N-]C(=O)c2cc(S(=O)(=O)[N-]c3ccc(O)c4ccccc34)ccc21	ZINC000226860047	548749564	/nfs/dbraw/zinc/74/95/64/548749564.db2.gz	BZJWHVKAQZLEEN-UHFFFAOYSA-N	-2	3	368.370	2.230	10	10		FECEHL