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GPCR

NameC-C chemokine receptor-like 2
SpeciesHomo sapiens (Human)
GeneCCRL2
SynonymACR5
CRAM-B
CRAM-A
CKRX
Chemokine receptor X
[ Show all ]
DiseaseN/A
Length344
Amino acid sequenceMANYTLAPEDEYDVLIEGELESDEAEQCDKYDAQALSAQLVPSLCSAVFVIGVLDNLLVVLILVKYKGLKRVENIYLLNLAVSNLCFLLTLPFWAHAGGDPMCKILIGLYFVGLYSETFFNCLLTVQRYLVFLHKGNFFSARRRVPCGIITSVLAWVTAILATLPEFVVYKPQMEDQKYKCAFSRTPFLPADETFWKHFLTLKMNISVLVLPLFIFTFLYVQMRKTLRFREQRYSLFKLVFAIMVVFLLMWAPYNIAFFLSTFKEHFSLSDCKSSYNLDKSVHITKLIATTHCCINPLLYAFLDGTFSKYLCRCFHLRSNTPLQPRGQSAQGTSREEPDHSTEV
UniProtO00421
Protein Data BankN/A
GPCR-HGmod modelO00421
3D structure modelThis predicted structure model is from GPCR-EXP O00421.
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL2321627
IUPHARN/A
DrugBankN/A

Ligand

NameCHEMBL2315935
Molecular formulaC26H28F3N5O2
IUPAC nameN-[1-[4-(2-hydroxyphenyl)cyclohexyl]azetidin-3-yl]-2-[[6-(trifluoromethyl)quinazolin-4-yl]amino]acetamide
Molecular weight499.538
Hydrogen bond acceptor9
Hydrogen bond donor3
XlogP4.6
SynonymsCHEMBL3704086
US9062048, 69
N-(1-(4-(2-hydroxyphenyl)cyclohexyl)azetidin-3-yl)-2-((6-(trifluoromethyl)quinazolin-4-yl)amino)acetamide
ZSIJRKFDESNGJM-UHFFFAOYSA-N
BDBM163442
[ Show all ]
Inchi KeyZSIJRKFDESNGJM-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H28F3N5O2/c27-26(28,29)17-7-10-22-21(11-17)25(32-15-31-22)30-12-24(36)33-18-13-34(14-18)19-8-5-16(6-9-19)20-3-1-2-4-23(20)35/h1-4,7,10-11,15-16,18-19,35H,5-6,8-9,12-14H2,(H,33,36)(H,30,31,32)
PubChem CID54772205
ChEMBLCHEMBL3704086
IUPHARN/A
BindingDB163442
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
IC507.0 nM, NoneBindingDB,ChEMBL

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