smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN(C)CCOC(=O)CCN1C(=O)/C(=C2/SC(=S)N(CCC(=O)OCC[NH+](C)C)C2=O)SC1=S	ZINC000100317941	554303611	/nfs/dbraw/zinc/30/36/11/554303611.db2.gz	XMHGMMJGDRVUFA-NXVVXOECSA-N	1	3	548.734	0.908	50	10		KCCAHO