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GPCR

NameD(1A) dopamine receptor
SpeciesBos taurus (Bovine)
GeneDRD1
SynonymDopamine D1 receptor
DiseaseN/A for non-human GPCRs
Length446
Amino acid sequenceMRTLNTSTMEGTGLVAERDFSFRILTACFLSLLILSTLLGNTLVCAAVIRFRHLRSKVTNFFVISLAVSDLLVAVLVMPWKAVAEIAGFWPFGSFCNIWVAFDIMCSTASILNLCVISVDRYWAISSPFRYERKMTPKAAFILISVAWTLSVLISFIPVQLSWHKAKPTGPSEGNATSLGKTINNCDSSLSRTYAISSSLISFYIPVAIMIVTYTRIYRIAQKQIRRISALERAAVHAKNCQTTTGNGNPMECSQPESSFKMSFKRETKVLKTLSVIMGVFVCCWLPFFILNCMVPFCGSGETKPFCIDSITFDVFVWFGWANSSLNPIIYAFNADFRKAFSTLLGCYRLCPTTNNAIETVSINNNGAVVFSSHHEPRGSISKDCNVVYLIPHAVGSSEGLKKEEAVGIAKPLEKLSPALSVILDYDTDVSLEKIQPITQNGQHPT
UniProtQ95136
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL2967
IUPHARN/A
DrugBankN/A

Ligand

NameCHEMBL167032
Molecular formulaC22H26ClN3O3
IUPAC name4-acetamido-N-[[(3R)-1-benzylpyrrolidin-3-yl]methyl]-5-chloro-2-methoxybenzamide
Molecular weight415.918
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP2.9
SynonymsBDBM50076031
N-[[(3R)-1-Benzyl-3beta-pyrrolidinyl]methyl]-2-methoxy-4-(acetylamino)-5-chlorobenzamide
4-Acetylamino-N-((R)-1-benzyl-pyrrolidin-3-ylmethyl)-5-chloro-2-methoxy-benzamide
Inchi KeyFUZBDAGWGHASHR-QGZVFWFLSA-N
Inchi IDInChI=1S/C22H26ClN3O3/c1-15(27)25-20-11-21(29-2)18(10-19(20)23)22(28)24-12-17-8-9-26(14-17)13-16-6-4-3-5-7-16/h3-7,10-11,17H,8-9,12-14H2,1-2H3,(H,24,28)(H,25,27)/t17-/m1/s1
PubChem CID44381117
ChEMBLCHEMBL167032
IUPHARN/A
BindingDB50076031
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Ki41000.0 nMPMID10206547BindingDB,ChEMBL

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