smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[S@@+](CCC[NH3+])C[C@H]1O[C@@H](n2cnc3c2ncnc3N)[C@H](O)[C@@H]1O	ZINC000004095557	571684900	/nfs/dbraw/zinc/68/49/00/571684900.db2.gz	ZUNBITIXDCPNSD-YHKGNIKMSA-N	2	0	355.444	-1.375	10	30	endogenous,in-man	FAEERP
C[S@+](CCC[NH3+])C[C@H]1O[C@@H](n2cnc3c2ncnc3N)[C@H](O)[C@@H]1O	ZINC000004095558	571684806	/nfs/dbraw/zinc/68/48/06/571684806.db2.gz	ZUNBITIXDCPNSD-OEIWOKJBSA-N	2	0	355.444	-1.375	10	30	endogenous,in-man	FAEERP
C=CC[NH2+][C@H](CCC(=O)C[N+]#N)C(=O)N[C@@H](CCC(=O)C[N+]#N)C(=O)[O-]	ZINC000026656956	210244197	/nfs/dbraw/zinc/24/41/97/210244197.db2.gz	LYUGICBKRYXVHJ-OLZOCXBDSA-N	2	0	364.362	-1.000	10	30		FAEERP