smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[NH+]1CCN(S(=O)(=O)CCC[NH+]2CCC(CNC(=O)c3cccc4c3OCCO4)CC2)CC1	ZINC000000602506	562918507	/nfs/dbraw/zinc/91/85/07/562918507.db2.gz	AUXZCLHKLUWDDZ-UHFFFAOYSA-N	2	2	480.631	0.867	10	0		JCAELP
Cc1ccc(S(=O)(=O)N(CCC[NH+]2CCOCC2)CCS(=O)(=O)N2CC[NH2+]CC2)c(C)c1	ZINC000015868844	556047181	/nfs/dbraw/zinc/04/71/81/556047181.db2.gz	SMSRGGYOAPJXNL-UHFFFAOYSA-N	2	2	488.676	0.251	10	0		JCAELP