smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC[N+](C)(CC)CCOc1ccc2c(c1)C(=O)c1cc(OCC[N+](C)(CC)CC)ccc1-2	ZINC000000642141	557124163	/nfs/dbraw/zinc/12/41/63/557124163.db2.gz	TYEZSLQHQJBOGW-UHFFFAOYSA-N	2	0	440.628	4.628	50	5		IJBARP
O=C(c1ccc([N+](=O)[O-])cc1)C(C[NH+]1CC2CCC(CC2)C1)C[NH+]1CC2CCC(CC2)C1	ZINC000071770306	557293249	/nfs/dbraw/zinc/29/32/49/557293249.db2.gz	MDDAITPRPQBVCA-UHFFFAOYSA-N	2	0	439.600	4.638	50	5		IJBARP