smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)[C@@H]2CC(=O)N(CC[NH+](C)C)C2)C1	ZINC000161410281	291241390	/nfs/dbraw/zinc/24/13/90/291241390.db2.gz	KWQBCYIBYSNVMW-KFWWJZLASA-N	2	1	324.469	0.241	10	70		DCIEMP
Cc1cccc(NC[C@H]2CC[N@H+](CCN3C(=O)CNC3=O)C2)[nH+]1	ZINC000160912462	416008374	/nfs/dbraw/zinc/00/83/74/416008374.db2.gz	DSKCGFSNAUTFBO-CYBMUJFWSA-N	2	1	317.393	0.676	10	70		DCIEMP
Cc1cccc(NC[C@H]2CC[N@@H+](CCN3C(=O)CNC3=O)C2)[nH+]1	ZINC000160912462	416008377	/nfs/dbraw/zinc/00/83/77/416008377.db2.gz	DSKCGFSNAUTFBO-CYBMUJFWSA-N	2	1	317.393	0.676	10	70		DCIEMP
Cc1cccc(NC[C@@H]2CC[N@H+](CCN3C(=O)CNC3=O)C2)[nH+]1	ZINC000160912352	416008954	/nfs/dbraw/zinc/00/89/54/416008954.db2.gz	DSKCGFSNAUTFBO-ZDUSSCGKSA-N	2	1	317.393	0.676	10	70		DCIEMP
Cc1cccc(NC[C@@H]2CC[N@@H+](CCN3C(=O)CNC3=O)C2)[nH+]1	ZINC000160912352	416008956	/nfs/dbraw/zinc/00/89/56/416008956.db2.gz	DSKCGFSNAUTFBO-ZDUSSCGKSA-N	2	1	317.393	0.676	10	70		DCIEMP