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GPCR

NameMu-type opioid receptor
SpeciesCavia porcellus (Guinea pig)
GeneOPRM1
SynonymM-OR-1
MOR-1
DiseaseN/A for non-human GPCRs
Length98
Amino acid sequenceYTKMKTATNIYIFNLALADALATSTLPFQSVNYLMGTWPFGTILCKIVISIDYYNMFTSIFTLCTMSVDRYIAVCHPVKALDFRTPRNAKTVNVCNWI
UniProtP97266
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL4354
IUPHARN/A
DrugBankN/A

Ligand

NameCHEMBL231049
Molecular formulaC24H31N3O2
IUPAC nameN-[1-[3-amino-3-(4-methylphenyl)propanoyl]piperidin-4-yl]-N-phenylpropanamide
Molecular weight393.531
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP2.7
SynonymsBDBM50206660
N-(1-(3-amino-3-p-tolylpropanoyl)piperidin-4-yl)-N-phenylpropionamide
Inchi KeyAEKPGIOXTWFYQA-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H31N3O2/c1-3-23(28)27(20-7-5-4-6-8-20)21-13-15-26(16-14-21)24(29)17-22(25)19-11-9-18(2)10-12-19/h4-12,21-22H,3,13-17,25H2,1-2H3
PubChem CID44425376
ChEMBLCHEMBL231049
IUPHARN/A
BindingDB50206660
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Inhibition24.0 %PMID17329100ChEMBL

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