BDBM50078288 2-Cyano-N-[(R)-2-(4-fluoro-phenoxy)-1-methyl-ethyl]-3,3-dimethyl-butyramide::CHEMBL42731

SMILES: C[C@H](COc1ccc(F)cc1)NC(=O)C(C#N)C(C)(C)C

InChI Key: InChIKey=QMFJMSKRWORECV-YNODCEANSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50078288   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Scytalone dehydratase (Magnaporthe grisea)	BDBM50078288 (2-Cyano-N-[(R)-2-(4-fluoro-phenoxy)-1-methyl-ethyl...) Show SMILES C[C@H](COc1ccc(F)cc1)NC(=O)C(C#N)C(C)(C)C Show InChI InChI=1S/C16H21FN2O2/c1-11(10-21-13-7-5-12(17)6-8-13)19-15(20)14(9-18)16(2,3)4/h5-8,11,14H,10H2,1-4H3,(H,19,20)/t11-,14?/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Stine-Haskell Research Center Curated by ChEMBL					Assay Description Inhibitory activity against scytalone dehydratase enzyme obtained from Magnaporthe grisea				Bioorg Med Chem Lett 9: 1607-12 (1999) BindingDB Entry DOI: 10.7270/Q2JH3KBD
					More data for this Ligand-Target Pair