smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C=CCn1nc(C(=O)N2CCCCC2)c2c1CC[C@H]([NH2+]C1CC[NH+](Cc3ccccc3)CC1)C2	ZINC000014538948	555828605	/nfs/dbraw/zinc/82/86/05/555828605.db2.gz	CBNWTIOZPLQKJL-DEOSSOPVSA-N	2	1	461.654	3.807	50	30		JHEAMP
C=CCn1nc(C(=O)N2CCCCC2)c2c1CC[C@@H]([NH2+]C1CC[NH+](Cc3ccccc3)CC1)C2	ZINC000014538949	555828593	/nfs/dbraw/zinc/82/85/93/555828593.db2.gz	CBNWTIOZPLQKJL-XMMPIXPASA-N	2	1	461.654	3.807	50	30		JHEAMP