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-])CCNC(=O)C[N@@H+](CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-]	ZINC000022942302	482549242	/nfs/dbraw/zinc/54/92/42/482549242.db2.gz	AJUKWYKWYHXJGM-UHFFFAOYSA-N	-3	2	363.323	-2.565	40	0		FAABLL
O=C([O-])CCNC(=O)C[N@H+](CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-]	ZINC000022942302	482549236	/nfs/dbraw/zinc/54/92/36/482549236.db2.gz	AJUKWYKWYHXJGM-UHFFFAOYSA-N	-3	2	363.323	-2.565	40	0		FAABLL
O=C([O-])[C@@H]1CN(C(=O)[O-])C(C(=O)[O-])(C(=O)[O-])C(C(=O)[O-])(C(=O)O)N1	ZINC000521825130	483529593	/nfs/dbraw/zinc/52/95/93/483529593.db2.gz	HAYZFQVRRORDSO-REOHCLBHSA-N	-5	2	350.192	-3.161	40	0		FAABLL
O=C([O-])[C@H]1CN(C(=O)[O-])C(C(=O)[O-])(C(=O)[O-])C(C(=O)[O-])(C(=O)O)N1	ZINC000521825132	483530080	/nfs/dbraw/zinc/53/00/80/483530080.db2.gz	HAYZFQVRRORDSO-UWTATZPHSA-N	-5	2	350.192	-3.161	40	0		FAABLL