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SMILES: Cc1nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n2c1CN1CCCC1c1ccccc1

InChI Key: InChIKey=AYPRBDIXIJJDIB-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50203622   
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))		BDBM50203622
PNG
(8-(2-chloro-4,6-dimethyl-phenyl)-2-methyl-3-(2-phe...)
Show SMILES Cc1nc2n(-c3c(C)cc(C)cc3Cl)c3ncccc3n2c1CN1CCCC1c1ccccc1 |w:27.32,(37.46,-4.03,;38.89,-3.45,;40.2,-4.26,;41.38,-3.28,;42.92,-3.17,;43.9,-4.35,;45.41,-4.08,;45.93,-2.63,;46.4,-5.25,;45.88,-6.71,;46.87,-7.89,;44.36,-6.97,;43.37,-5.79,;41.85,-6.06,;43.29,-1.68,;44.66,-.96,;44.72,.59,;43.34,1.48,;42.03,.69,;41.98,-.85,;40.8,-1.84,;39.26,-1.95,;38.27,-.78,;38.79,.67,;40.27,1.09,;40.32,2.63,;38.87,3.16,;37.92,1.94,;36.39,1.99,;35.66,3.35,;34.13,3.39,;33.31,2.08,;34.05,.72,;35.59,.68,)|
Show InChI InChI=1S/C28H28ClN5/c1-18-15-19(2)26(22(29)16-18)34-27-24(11-7-13-30-27)33-25(20(3)31-28(33)34)17-32-14-8-12-23(32)21-9-5-4-6-10-21/h4-7,9-11,13,15-16,23H,8,12,14,17H2,1-3H3
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Article
PubMed
 580n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]Tyr-o-CRF from CRF1 receptor expressed in IMR32 cells assessed as inhibition of CRF stimulated cAMP production

Bioorg Med Chem Lett 17: 2026-30 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.008
BindingDB Entry DOI: 10.7270/Q21R6Q5Q
More data for this
Ligand-Target Pair