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)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](CC1CCCCC1)[C@H](O)[C@H](O)CN=[N+]=[N-]	ZINC000028771077	561961315	/nfs/dbraw/zinc/96/13/15/561961315.db2.gz	KYZQHPHXYFTWRL-KQZFZZGISA-N	0	1	596.733	2.308	10	10		KECEMN
CC[C@]1(O)C[C@H](O[C@@H]2C[C@H]([NH+](C)C)[C@H](O)[C@H](C)O2)c2c([O-])c3c(cc2[C@H]1C(=O)OC)C(=O)c1cccc(O)c1C3=O	ZINC000038147302	562065515	/nfs/dbraw/zinc/06/55/15/562065515.db2.gz	LJZPVWKMAYDYAS-CVSSFTMOSA-N	0	1	569.607	2.158	10	10		KECEMN