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GPCR

NameOxytocin receptor
SpeciesRattus norvegicus (Rat)
GeneOxtr
SynonymOT receptor
OT-R
OTR
DiseaseN/A for non-human GPCRs
Length388
Amino acid sequenceMEGTPAANWSVELDLGSGVPPGEEGNRTAGPPQRNEALARVEVAVLCLILFLALSGNACVLLALRTTRHKHSRLFFFMKHLSIADLVVAVFQVLPQLLWDITFRFYGPDLLCRLVKYLQVVGMFASTYLLLLMSLDRCLAICQPLRSLRRRTDRLAVLGTWLGCLVASAPQVHIFSLREVADGVFDCWAVFIQPWGPKAYVTWITLAVYIVPVIVLAACYGLISFKIWQNLRLKTAAAAAAAEGNDAAGGAGRAALARVSSVKLISKAKIRTVKMTFIIVLAFIVCWTPFFFVQMWSVWDVNAPKEASAFIIAMLLASLNSCCNPWIYMLFTGHLFHELVQRFFCCSARYLKGSRPGETSVSKKSNSSTFVLSRRSSSQRSCSQPSSA
UniProtP70536
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL3996
IUPHAR369
DrugBankN/A

Ligand

NameCHEMBL419603
Molecular formulaC24H25NO2S
IUPAC name1-(4-methylphenyl)sulfonyl-4,4-diphenylpiperidine
Molecular weight391.529
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP5.3
Synonyms4,4-Diphenyl-1-(toluene-4-sulfonyl)-piperidine
1-[(4-Methylphenyl)sulfonyl]-4,4-diphenylpiperidine
BDBM50001414
Inchi KeyCZLGWQNCMKBTFW-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H25NO2S/c1-20-12-14-23(15-13-20)28(26,27)25-18-16-24(17-19-25,21-8-4-2-5-9-21)22-10-6-3-7-11-22/h2-15H,16-19H2,1H3
PubChem CID10363060
ChEMBLCHEMBL419603
IUPHARN/A
BindingDB50001414
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Experimental Data

ParameterValueReferenceDatabase source
IC50<10000.0 nMPMID1331449BindingDB,ChEMBL

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