smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCCCCC[N@H+](C)c1ccc(CCC([NH3+])(CO)CO)cc1	ZINC000042989764	183326085	/nfs/dbraw/zinc/32/60/85/183326085.db2.gz	JNISPGASAYSFRW-UHFFFAOYSA-N	2	2	322.493	2.708	1	30		DFEFLP
CCCCCCC[N@@H+](C)c1ccc(CCC([NH3+])(CO)CO)cc1	ZINC000042989764	183326087	/nfs/dbraw/zinc/32/60/87/183326087.db2.gz	JNISPGASAYSFRW-UHFFFAOYSA-N	2	2	322.493	2.708	1	30		DFEFLP