smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN(C)c1ccc2c(c1)nc1cc(N(C)C)ccc1c2SCC[N@H+](C)Cc1ccccc1	ZINC000071767291	556887561	/nfs/dbraw/zinc/88/75/61/556887561.db2.gz	NHXIJTZAOBAALE-UHFFFAOYSA-N	1	3	444.648	5.744	50	5		IKBAHO
CN(C)c1ccc2c(c1)nc1cc(N(C)C)ccc1c2SCC[N@@H+](C)Cc1ccccc1	ZINC000071767291	556887564	/nfs/dbraw/zinc/88/75/64/556887564.db2.gz	NHXIJTZAOBAALE-UHFFFAOYSA-N	1	3	444.648	5.744	50	5		IKBAHO