BDBM50387632 CHEMBL2058335

SMILES: CC[C@@H](C1CC1)n1c2nccc(-c3ccc(OC(F)F)cc3Cl)c2nc(C)c1=O

InChI Key: InChIKey=YWRIOXBMMCYSQH-KRWDZBQOSA-N

Data: 1 IC50

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 = 50387632   

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
Corticotropin releasing factor receptor (Rattus norvegicus (rat))	BDBM50387632 (CHEMBL2058335) Show SMILES CC[C@@H](C1CC1)n1c2nccc(-c3ccc(OC(F)F)cc3Cl)c2nc(C)c1=O |r| Show InChI InChI=1S/C21H20ClF2N3O2/c1-3-17(12-4-5-12)27-19-18(26-11(2)20(27)28)15(8-9-25-19)14-7-6-13(10-16(14)22)29-21(23)24/h6-10,12,17,21H,3-5H2,1-2H3/t17-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.30	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Co Curated by ChEMBL					Assay Description Antagonist activity at rat CFR1R				Bioorg Med Chem Lett 22: 4986-9 (2012) Article DOI: 10.1016/j.bmcl.2012.06.034 BindingDB Entry DOI: 10.7270/Q23X87Q6
					More data for this Ligand-Target Pair