smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[NH+](Cc3ccc4cccnc4c3O)CC2)cc1	ZINC000053230247	563141383	/nfs/dbraw/zinc/14/13/83/563141383.db2.gz	OYHOETVIOGVJPP-UHFFFAOYSA-N	1	2	428.470	2.355	1	10		IECFLO
COc1ccc(S(=O)(=O)N2CC[NH+](Cc3ccc4cccnc4c3O)CC2)cc1OC	ZINC000053242963	563141478	/nfs/dbraw/zinc/14/14/78/563141478.db2.gz	UMQNQYUOUMUWRJ-UHFFFAOYSA-N	1	2	443.525	2.464	1	10		IECFLO
O=[N+]([O-])c1ccccc1S(=O)(=O)N1CC[NH+](Cc2ccc3cccnc3c2O)CC1	ZINC000053314291	563142095	/nfs/dbraw/zinc/14/20/95/563142095.db2.gz	IFPYFCNTTMUOMY-UHFFFAOYSA-N	1	2	428.470	2.355	1	10		IECFLO