smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCCCCCC/C=C/CCCCCCCC(=O)NCCC[NH2+]CCCC[NH2+]CCCN	ZINC000044182272	563171872	/nfs/dbraw/zinc/17/18/72/563171872.db2.gz	MLKSKAFQVXZZBV-MDZDMXLPSA-N	2	3	466.799	5.838	1	30		JKEFHP
CCCCCCCCCCCCCCCCS(=O)(=O)N(CCC[NH3+])CCCC[NH2+]CCCN	ZINC000043543974	563170317	/nfs/dbraw/zinc/17/03/17/563170317.db2.gz	QQOLIBWLEBZQAT-UHFFFAOYSA-N	2	3	490.843	5.167	1	30		JKEFHP
CCCCCCCCCCCCCCCCS(=O)(=O)NCCC[NH2+]CCCC[NH2+]CCCN	ZINC000036185365	563123976	/nfs/dbraw/zinc/12/39/76/563123976.db2.gz	WXJKHYHSCXNLGP-UHFFFAOYSA-N	2	3	490.843	5.085	1	30		JKEFHP