smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[N+](C)(C)CC(=O)NNC(C(=O)Nc1ccc(Cl)cc1)=C1C(N)=NN(c2ccccc2)C1=O	ZINC000102954935	717146194	/nfs/dbraw/zinc/14/61/94/717146194.db2.gz	WBUXOQXZNWQODY-SFHVURJKSA-O	1	0	470.941	1.392	1	50		JDGFRO
C[N+](C)(C)CC(=O)NNC(C(=O)Nc1ccc(Cl)cc1)=C1C(N)=NN(c2ccccc2)C1=O	ZINC000018180367	717112840	/nfs/dbraw/zinc/11/28/40/717112840.db2.gz	WBUXOQXZNWQODY-GOSISDBHSA-O	1	0	470.941	1.392	1	50		JDGFRO
CC[C@@]1(O)C(=O)OCc2c(=O)n3c(cc21)-c1nc2ccccc2c(/C=N/NC(=O)C[N+](C)(C)C)c1C3	ZINC000005822472	717102882	/nfs/dbraw/zinc/10/28/82/717102882.db2.gz	SVYPWFUWTZSGBG-SANMLTNESA-O	1	0	490.540	1.236	1	50		JDGFRO