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GPCR

NameCorticotropin-releasing factor receptor 1
SpeciesRattus norvegicus (Rat)
GeneCrhr1
SynonymCRH-R1
CRH-R-1
CRFR1
CRFR-1
CRF1 receptor
[ Show all ]
DiseaseN/A for non-human GPCRs
Length415
Amino acid sequenceMGRRPQLRLVKALLLLGLNPVSTSLQDQRCENLSLTSNVSGLQCNASVDLIGTCWPRSPAGQLVVRPCPAFFYGVRYNTTNNGYRECLANGSWAARVNYSECQEILNEEKKSKVHYHVAVIINYLGHCISLVALLVAFVLFLRLRSIRCLRNIIHWNLISAFILRNATWFVVQLTVSPEVHQSNVAWCRLVTAAYNYFHVTNFFWMFGEGCYLHTAIVLTYSTDRLRKWMFVCIGWGVPFPIIVAWAIGKLHYDNEKCWFGKRPGVYTDYIYQGPMILVLLINFIFLFNIVRILMTKLRASTTSETIQYRKAVKATLVLLPLLGITYMLFFVNPGEDEVSRVVFIYFNSFLESFQGFFVSVFYCFLNSEVRSAIRKRWRRWQDKHSIRARVARAMSIPTSPTRVSFHSIKQSTAV
UniProtP35353
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL4649
IUPHAR212
DrugBankN/A

Ligand

NameCHEMBL2165199
Molecular formulaC17H19Cl3FN3O4
IUPAC name5-chloro-3-[2,6-dichloro-4-(2-fluoroethoxy)anilino]-1-(1,3-dimethoxypropan-2-yl)pyrazin-2-one
Molecular weight454.704
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP3.0
SynonymsBDBM50395829
Inchi KeyAJSIYBPKKUNKIS-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H19Cl3FN3O4/c1-26-8-10(9-27-2)24-7-14(20)22-16(17(24)25)23-15-12(18)5-11(6-13(15)19)28-4-3-21/h5-7,10H,3-4,8-9H2,1-2H3,(H,22,23)
PubChem CID71449777
ChEMBLCHEMBL2165199
IUPHARN/A
BindingDB50395829
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Experimental Data

ParameterValueReferenceDatabase source
IC50210.0 nMPMID23010264BindingDB,ChEMBL

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