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)CCNc1ccc(NCCN(CCO)CCO)c2c1C(=O)c1c(O)ccc(O)c1C2=O	ZINC000029486619	563105602	/nfs/dbraw/zinc/10/56/02/563105602.db2.gz	PQHCFYOBELSBBT-UHFFFAOYSA-N	0	1	472.542	0.545	1	10		JCCFMN
NC(=[NH2+])NCCC[C@H](NC(=O)c1sccc1S(=O)(=O)Nc1ccc(N)cc1)C(=O)[O-]	ZINC000049035563	563198771	/nfs/dbraw/zinc/19/87/71/563198771.db2.gz	QNYMPNWKUIWUKD-LBPRGKRZSA-N	0	1	454.534	0.577	1	10		JCCFMN
NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)C=Cc1ccc(O)c(O)c1	ZINC000053226508	563205239	/nfs/dbraw/zinc/20/52/39/563205239.db2.gz	KHKPJHIEFNBLEO-NNIASQDCSA-N	0	1	463.494	0.774	1	10		JCCFMN
NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)C=Cc1ccc(O)c(O)c1	ZINC000053293499	563205516	/nfs/dbraw/zinc/20/55/16/563205516.db2.gz	JWDXQZSZCZXMHV-NNIASQDCSA-N	0	1	463.494	0.774	1	10		JCCFMN