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SMILES: COc1cc(C)n(C[C@H]2CC[C@@H](CC2)NC(=O)c2cc(ccc2Cl)C(F)(F)F)n1

InChI Key: InChIKey=ASLHIRDCUBBIEL-CTYIDZIISA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 131877   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))		BDBM131877
PNG
(US8835444, 5.8)
Show SMILES COc1cc(C)n(C[C@H]2CC[C@@H](CC2)NC(=O)c2cc(ccc2Cl)C(F)(F)F)n1 |r,wU:8.7,wD:11.14,(9.52,3.25,;9.13,1.77,;7.64,1.37,;7.16,-.1,;5.62,-.1,;4.85,-1.43,;5.15,1.37,;3.81,2.14,;2.48,1.37,;2.48,-.17,;1.15,-.94,;-.19,-.17,;-.19,1.37,;1.15,2.14,;-1.52,-.94,;-2.86,-.17,;-2.86,1.37,;-4.19,-.94,;-5.52,-.17,;-6.86,-.94,;-6.86,-2.48,;-5.52,-3.25,;-4.19,-2.48,;-2.86,-3.25,;-8.19,-.17,;-8.19,1.37,;-9.52,-.94,;-9.52,.6,;6.39,2.27,)|
Show InChI InChI=1S/C20H23ClF3N3O2/c1-12-9-18(29-2)26-27(12)11-13-3-6-15(7-4-13)25-19(28)16-10-14(20(22,23)24)5-8-17(16)21/h5,8-10,13,15H,3-4,6-7,11H2,1-2H3,(H,25,28)/t13-,15-
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Similars
US Patent
n/an/a 126n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
Chinese hamster ovary (CHO) cells expressing either the human or rat recombinant CRF-1 or human CRF-2alpha (Chen et al, Proc Natl Acad Sci USA 90, 89...

US Patent US8835444 (2014)


BindingDB Entry DOI: 10.7270/Q28K77ST
More data for this
Ligand-Target Pair