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)OC[C@@H]1O[C@@H]([S-])[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O	ZINC000004802686	207050353	/nfs/dbraw/zinc/05/03/53/207050353.db2.gz	SFOZKJGZNOBSHF-VJTDZRGJSA-N	-1	3	364.372	-0.001	10	30		FBEEHM
CC(=O)OC[C@H]1O[C@@H]([S-])[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O	ZINC000004802694	204164659	/nfs/dbraw/zinc/16/46/59/204164659.db2.gz	SFOZKJGZNOBSHF-KSTCHIGDSA-N	-1	3	364.372	-0.001	10	30	in-vitro	FBEEHM
C[C@]1(O)C[C@]2(O)C=CC3=C(C(=O)c4cccc([O-])c4C3=O)[C@@]2(O)C(=O)[C@@H]1O	ZINC000014689396	211097748	/nfs/dbraw/zinc/09/77/48/211097748.db2.gz	TVRZORMBTKRMAO-GDAAHCPNSA-N	-1	3	372.329	-0.816	10	30		FBEEHM