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GPCR

NameMu-type opioid receptor
SpeciesMus musculus (Mouse)
GeneOprm1
Synonymopioid receptor, mu 1
opioid receptor
OP3
Mu receptor
MOR-1
[ Show all ]
DiseaseN/A for non-human GPCRs
Length398
Amino acid sequenceMDSSAGPGNISDCSDPLAPASCSPAPGSWLNLSHVDGNQSDPCGPNRTGLGGSHSLCPQTGSPSMVTAITIMALYSIVCVVGLFGNFLVMYVIVRYTKMKTATNIYIFNLALADALATSTLPFQSVNYLMGTWPFGNILCKIVISIDYYNMFTSIFTLCTMSVDRYIAVCHPVKALDFRTPRNAKIVNVCNWILSSAIGLPVMFMATTKYRQGSIDCTLTFSHPTWYWENLLKICVFIFAFIMPVLIITVCYGLMILRLKSVRMLSGSKEKDRNLRRITRMVLVVVAVFIVCWTPIHIYVIIKALITIPETTFQTVSWHFCIALGYTNSCLNPVLYAFLDENFKRCFREFCIPTSSTIEQQNSARIRQNTREHPSTANTVDRTNHQLENLEAETAPLP
UniProtP42866
Protein Data Bank4dkl, 5c1m, 6dde, 6ddf
GPCR-HGmod modelN/A
3D structure modelThis structure is from PDB ID 4dkl.
BioLiPBL0416752, BL0416751, BL0321492, BL0224753, BL0224754, BL0224755,BL0224756, BL0321491
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL2858
IUPHAR319
DrugBankN/A

Ligand

NameCHEMBL93614
Molecular formulaC22H29NO2
IUPAC name3-[(3R,4R)-1-(2-hydroxy-3-phenylpropyl)-3,4-dimethylpiperidin-4-yl]phenol
Molecular weight339.479
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP4.5
Synonyms3-[(3R,4R)-1-(2-Hydroxy-3-phenylpropyl)-3,4-dimethyl-4-piperidinyl]phenol
BDBM50045766
3-[1-(2-Hydroxy-3-phenyl-propyl)-3,4-dimethyl-piperidin-4-yl]-phenol
Inchi KeyAPTJADCVFISWLZ-QNGGVGCWSA-N
Inchi IDInChI=1S/C22H29NO2/c1-17-15-23(16-21(25)13-18-7-4-3-5-8-18)12-11-22(17,2)19-9-6-10-20(24)14-19/h3-10,14,17,21,24-25H,11-13,15-16H2,1-2H3/t17-,21?,22+/m0/s1
PubChem CID9997334
ChEMBLCHEMBL93614
IUPHARN/A
BindingDB50045766
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
AD500.27 mg kg-1PMID8410998ChEMBL

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