smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCC(=O)[C@@H](CC)/C(CCC(=O)N(Cc1ccccc1)Cc1ccccc1)=N/NC(=O)C[N+](C)(C)C	ZINC000005811480	717101748	/nfs/dbraw/zinc/10/17/48/717101748.db2.gz	NIYOCWPADJKIDC-DJDJECJDSA-O	1	0	507.699	4.569	40	50		KJGBRO
CCCC(=O)[C@H](CC)/C(CCC(=O)N(Cc1ccccc1)Cc1ccccc1)=N/NC(=O)C[N+](C)(C)C	ZINC000005811482	717102075	/nfs/dbraw/zinc/10/20/75/717102075.db2.gz	NIYOCWPADJKIDC-JNWXKXLUSA-O	1	0	507.699	4.569	40	50		KJGBRO
CCCC(=O)[C@@H](CC)/C(CCC(=O)N(Cc1ccccc1)Cc1ccccc1)=N\NC(=O)C[N+](C)(C)C	ZINC000016952968	717112453	/nfs/dbraw/zinc/11/24/53/717112453.db2.gz	NIYOCWPADJKIDC-WUZNOGLBSA-O	1	0	507.699	4.569	40	50		KJGBRO
CCCC(=O)[C@H](CC)/C(CCC(=O)N(Cc1ccccc1)Cc1ccccc1)=N\NC(=O)C[N+](C)(C)C	ZINC000017188814	717112369	/nfs/dbraw/zinc/11/23/69/717112369.db2.gz	NIYOCWPADJKIDC-NSSHJNEVSA-O	1	0	507.699	4.569	40	50		KJGBRO