smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
[NH3+]CCCC[C@H](NC(=O)c1cccc(O)c1[O-])C(=O)N[C@@H](CO)C(=O)[O-]	ZINC000013387744	560216347	/nfs/dbraw/zinc/21/63/47/560216347.db2.gz	NNTXFOAPABMVEG-QWRGUYRKSA-N	-1	3	369.374	-1.113	1	10	in-vitro	FACFHM
[NH3+]CCCC[C@H](NC(=O)c1cccc(O)c1[O-])C(=O)N[C@H](CO)C(=O)[O-]	ZINC000013387745	560216288	/nfs/dbraw/zinc/21/62/88/560216288.db2.gz	NNTXFOAPABMVEG-WDEREUQCSA-N	-1	3	369.374	-1.113	1	10	in-vitro	FACFHM
[NH3+]CCCC[C@@H](NC(=O)c1cccc(O)c1[O-])C(=O)N[C@H](CO)C(=O)[O-]	ZINC000013387746	560216340	/nfs/dbraw/zinc/21/63/40/560216340.db2.gz	NNTXFOAPABMVEG-GHMZBOCLSA-N	-1	3	369.374	-1.113	1	10	in-vitro	FACFHM
COC(=O)[C@H](OC(=O)c1cc(O)c([O-])c(O)c1)[C@H]1OC(=O)[C@@H](O)[C@@H]1O	ZINC000015249563	291019166	/nfs/dbraw/zinc/01/91/66/291019166.db2.gz	RQUDYYZIFCIQQF-XWLWVQCSSA-N	-1	3	358.255	-1.851	1	10	endogenous,in-man	FACFHM
COC(=O)[C@@H](O)[C@@H]1OC(=O)[C@H](OC(=O)c2cc(O)c([O-])c(O)c2)[C@H]1O	ZINC000039095126	291019150	/nfs/dbraw/zinc/01/91/50/291019150.db2.gz	DTDWLEXEERIYFQ-UKKRHICBSA-N	-1	3	358.255	-1.851	1	10	biogenic,in-vitro	FACFHM