smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(=O)N1CCC[N@H+](C[C@@H]2OC[C@H]([NH2+]Cc3ccccc3O)[C@H]2O)CC1	ZINC000514288418	490768474	/nfs/dbraw/zinc/76/84/74/490768474.db2.gz	DOMNJAYCCSHOQJ-YTQUADARSA-N	2	1	363.458	0.164	40	10	biogenic,in-vitro	FCCBMP
CC(=O)N1CCC[N@@H+](C[C@@H]2OC[C@H]([NH2+]Cc3ccccc3O)[C@H]2O)CC1	ZINC000514288418	490768476	/nfs/dbraw/zinc/76/84/76/490768476.db2.gz	DOMNJAYCCSHOQJ-YTQUADARSA-N	2	1	363.458	0.164	40	10	biogenic,in-vitro	FCCBMP