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[n+](CCC[N+](C)(C)C)c2ccccc12	ZINC000038457903	210493033	/nfs/dbraw/zinc/49/30/33/210493033.db2.gz	BCTNMRNAMOIDHS-UHFFFAOYSA-N	2	0	391.584	4.764	10	10	in-vitro	GJCERP
CCN(CC)c1ccc(/C=C/C=Cc2cc[n+](CCC[N+](C)(C)C)cc2)cc1	ZINC000002565900	209369495	/nfs/dbraw/zinc/36/94/95/209369495.db2.gz	IVDRFDSGNPGQSI-UHFFFAOYSA-N	2	0	379.592	4.643	10	10		GJCERP
C[N+](C)(C)CC[NH2+]CCc1ccc(/N=N/c2ccc([N+](=O)[O-])cc2Cl)cc1	ZINC000034303671	717124299	/nfs/dbraw/zinc/12/42/99/717124299.db2.gz	AKIYYDSXDIXEOB-GHVJWSGMSA-N	2	0	390.895	4.502	10	10		GJCERP