smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC[NH+]1CC[N+]2(CCCC2)CC1	29333868	167221988	/nfs/dbraw/zinc/22/19/88/167221988.db2.gz	IDVVQLXLSWIVFL-UHFFFAOYSA-N	2	1	169.292	0.933	1	5		ACBFMP
[NH3+]CC[C@@]1([N+](=O)[O-])C=C[NH+]=CC1	5542550	169194719	/nfs/dbraw/zinc/19/47/19/169194719.db2.gz	ZDIFPEMIUPUPQT-SSDOTTSWSA-N	2	1	169.184	0.339	1	5		ACBFMP
[NH3+]CC[C@]1([N+](=O)[O-])C=C[NH+]=CC1	5566624	169196561	/nfs/dbraw/zinc/19/65/61/169196561.db2.gz	ZDIFPEMIUPUPQT-ZETCQYMHSA-N	2	1	169.184	0.339	1	5		ACBFMP