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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

NameCHEMBL561225
Molecular formulaC18H17F3N4O2
IUPAC name1-[(1R)-1-cyclopropylethyl]-5-ethynyl-3-[[6-methoxy-2-(trifluoromethyl)pyridin-3-yl]amino]pyrazin-2-one
Molecular weight378.355
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP2.4
SynonymsBDBM50293989
(R)-1-(1-Cyclopropylethyl)-5-ethynyl-3-[6-methoxy-2-(trifluoromethyl)pyridin-3-ylamino]pyrazin-2(1H)-one
Inchi KeyFFUTZEOOGWFPMZ-SNVBAGLBSA-N
Inchi IDInChI=1S/C18H17F3N4O2/c1-4-12-9-25(10(2)11-5-6-11)17(26)16(22-12)23-13-7-8-14(27-3)24-15(13)18(19,20)21/h1,7-11H,5-6H2,2-3H3,(H,22,23)/t10-/m1/s1
PubChem CID44190559
ChEMBLCHEMBL561225
IUPHARN/A
BindingDB50293989
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
IC505.6 nMPMID19552437BindingDB,ChEMBL

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