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-])CN(CC[N@@H+](CC(=O)[O-])CC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)[O-])CC(=O)[O-]	ZINC000023255778	556035548	/nfs/dbraw/zinc/03/55/48/556035548.db2.gz	HNKLWQJNERCAQA-LBPRGKRZSA-N	-3	2	471.419	-1.933	40	10		JACBLL
O=C([O-])CN(CC[N@H+](CC(=O)[O-])CC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)[O-])CC(=O)[O-]	ZINC000023255778	556035545	/nfs/dbraw/zinc/03/55/45/556035545.db2.gz	HNKLWQJNERCAQA-LBPRGKRZSA-N	-3	2	471.419	-1.933	40	10		JACBLL
O=C([O-])CN(CC[N@@H+](CC(=O)[O-])CC(=O)N[C@H](Cc1ccc(O)c(O)c1)C(=O)[O-])CC(=O)[O-]	ZINC000023255781	556035631	/nfs/dbraw/zinc/03/56/31/556035631.db2.gz	HNKLWQJNERCAQA-GFCCVEGCSA-N	-3	2	471.419	-1.933	40	10		JACBLL
O=C([O-])CN(CC[N@H+](CC(=O)[O-])CC(=O)N[C@H](Cc1ccc(O)c(O)c1)C(=O)[O-])CC(=O)[O-]	ZINC000023255781	556035628	/nfs/dbraw/zinc/03/56/28/556035628.db2.gz	HNKLWQJNERCAQA-GFCCVEGCSA-N	-3	2	471.419	-1.933	40	10		JACBLL