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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

NameCHEMBL2315938
Molecular formulaC24H24F6N6O2S
IUPAC name2-[[2,6-bis(trifluoromethyl)quinazolin-4-yl]amino]-N-[1-[4-hydroxy-4-(1,3-thiazol-5-yl)cyclohexyl]azetidin-3-yl]acetamide
Molecular weight574.546
Hydrogen bond acceptor14
Hydrogen bond donor3
XlogP3.9
SynonymsSCHEMBL15214619
BDBM50425713
US9062048, 87
CHEMBL3977436
SCHEMBL9999469
[ Show all ]
Inchi KeyVSEDSFRLQXFULM-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H24F6N6O2S/c25-23(26,27)13-1-2-17-16(7-13)20(35-21(34-17)24(28,29)30)32-9-19(37)33-14-10-36(11-14)15-3-5-22(38,6-4-15)18-8-31-12-39-18/h1-2,7-8,12,14-15,38H,3-6,9-11H2,(H,33,37)(H,32,34,35)
PubChem CID71552260
ChEMBLCHEMBL3977436
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 10 hydrogen bond acceptor.
This ligand is heavier than 500 daltons.

Experimental Data

ParameterValueReferenceDatabase source
IC5039.0 nMNoneChEMBL

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