smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCN(CC)CCNC(=O)C(=O)NC[C@@H]1OCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000008684086	562951957	/nfs/dbraw/zinc/95/19/57/562951957.db2.gz	PGHALHMYKSQSBZ-INIZCTEOSA-N	0	3	457.509	-0.484	50	5		JBBAHN
CCN(CC)CCNC(=O)C(=O)NC[C@H]1OCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000008684087	562951961	/nfs/dbraw/zinc/95/19/61/562951961.db2.gz	PGHALHMYKSQSBZ-MRXNPFEDSA-N	0	3	457.509	-0.484	50	5		JBBAHN