smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN1c2ccccc2S/C1=C/c1cc(N2CC[N+](C)(C)CC2)[n+](-c2ccccc2)c2ccccc12	ZINC000168937143	717154985	/nfs/dbraw/zinc/15/49/85/717154985.db2.gz	VTCWZJCLSQDDNF-UHFFFAOYSA-N	2	0	480.681	5.553	10	5		JKBERP
c1cc2cc3ccc(OCCC[NH+]4CCCCC4)cc3nc2cc1OCCC[NH+]1CCCCC1	ZINC000029416915	563103763	/nfs/dbraw/zinc/10/37/63/563103763.db2.gz	PGHVEWRWACYJGD-UHFFFAOYSA-N	2	0	461.650	5.898	10	5		JKBERP
CC[NH+](CC)CCC[C@H](C)Nc1cc(/C=C\c2ccc([N+](=O)[O-])cc2)[nH+]c2ccc(OC)cc12	ZINC000033246215	563110416	/nfs/dbraw/zinc/11/04/16/563110416.db2.gz	XWBADQOPXPRKBX-DBBZSVRUSA-N	2	0	462.594	6.244	10	5		JKBERP
CC[NH+](CC)CCC[C@@H](C)Nc1cc(/C=C\c2ccc([N+](=O)[O-])cc2)[nH+]c2ccc(OC)cc12	ZINC000033246214	563110429	/nfs/dbraw/zinc/11/04/29/563110429.db2.gz	XWBADQOPXPRKBX-FNUUXAGOSA-N	2	0	462.594	6.244	10	5		JKBERP