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GPCR

NameCorticotropin-releasing factor receptor 2
SpeciesMus musculus (Mouse)
GeneCrhr2
SynonymCRFR-2
CRFR2
CRFR2alpha
CRFR2beta
CRH-R-2
[ Show all ]
DiseaseN/A for non-human GPCRs
Length411
Amino acid sequenceMDAALLLSLLEANCSLALAEELLLDGWGVPPDPEGPYTYCNTTLDQIGTCWPQSAPGALVERPCPEYFNGIKYNTTRNAYRECLENGTWASRVNYSHCEPILDDKQRKYDLHYRIALIVNYLGHCVSVVALVAAFLLFLVLRSIRCLRNVIHWNLITTFILRNIAWFLLQLIDHEVHEGNEVWCRCITTIFNYFVVTNFFWMFVEGCYLHTAIVMTYSTEHLRKWLFLFIGWCIPCPIIIAWAVGKLYYENEQCWFGKEAGDLVDYIYQGPVMLVLLINFVFLFNIVRILMTKLRASTTSETIQYRKAVKATLVLLPLLGITYMLFFVNPGEDDLSQIVFIYFNSFLQSFQGFFVSVFYCFFNGEVRAALRKRWHRWQDHHALRVPVARAMSIPTSPTRISFHSIKQTAAV
UniProtQ60748
Protein Data Bank2jnd
GPCR-HGmod modelN/A
3D structure modelThis structure is from PDB ID 2jnd.
BioLiPBL0101313
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL2253
IUPHAR213
DrugBankN/A

Ligand

NameCHEMBL164829
Molecular formulaC20H18N6O2
IUPAC nameN-(2-aminoethyl)-20-hydroxy-3,6,10,12-tetrazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-1(20),2,7,9,11,13(21),14,16,18-nonaene-8-carboxamide
Molecular weight374.404
Hydrogen bond acceptor7
Hydrogen bond donor4
XlogP0.4
SynonymsBDBM50075924
N-(2-Aminoethyl)-5,6-(iminoethyleneimino)-7-oxo-7H-benzo[e]perimidine-4-carboxamide
13-Oxo-10,11,12,13-tetrahydro-9H-5,7,9,12-tetraaza-dibenzo[a,de]anthracen-8-carboxylic acid (2-amino-ethyl)-amide
Inchi KeyVXGJDYBLBWXYBM-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H18N6O2/c21-5-6-24-20(28)14-16-12-13(17-18(14)23-8-7-22-17)19(27)11-4-2-1-3-10(11)15(12)25-9-26-16/h1-4,9,23,27H,5-8,21H2,(H,24,28)
PubChem CID135884427
ChEMBLCHEMBL164829
IUPHARN/A
BindingDB50075924
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Ki650.0 nMPMID10201844BindingDB,ChEMBL

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