smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccc(/C(C[C@H]2OC(=O)c3ccccc32)=N\NC(=O)C[N+](C)(C)C)cc1	ZINC000005832206	717102430	/nfs/dbraw/zinc/10/24/30/717102430.db2.gz	UFHWSDAVPJUQDQ-LBMWUGKUSA-O	1	0	396.467	2.524	40	50		GFGBRO
COc1ccc(/C(C[C@H]2OC(=O)c3ccccc32)=N/NC(=O)C[N+](C)(C)C)cc1	ZINC000017215496	717113114	/nfs/dbraw/zinc/11/31/14/717113114.db2.gz	UFHWSDAVPJUQDQ-PAYQVUOSSA-O	1	0	396.467	2.524	40	50		GFGBRO
COc1ccc(/C(C[C@@H]2OC(=O)c3ccccc32)=N/NC(=O)C[N+](C)(C)C)cc1	ZINC000016958128	717112404	/nfs/dbraw/zinc/11/24/04/717112404.db2.gz	UFHWSDAVPJUQDQ-LOKSUBMMSA-O	1	0	396.467	2.524	40	50		GFGBRO
COc1ccc(/C(C[C@@H]2OC(=O)c3ccccc32)=N\NC(=O)C[N+](C)(C)C)cc1	ZINC000005832214	717102916	/nfs/dbraw/zinc/10/29/16/717102916.db2.gz	UFHWSDAVPJUQDQ-ZNCVUUBVSA-O	1	0	396.467	2.524	40	50		GFGBRO