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GPCR

NameCysteinyl leukotriene receptor 1
SpeciesCavia porcellus (Guinea pig)
GeneCYSLTR1
SynonymCysLTR1
Cysteinyl leukotriene D4 receptor
LTD4 receptor
DiseaseN/A for non-human GPCRs
Length340
Amino acid sequenceMDETGNPTIPPASNNTCYDSIDDFRNQVYSTLYSMISVVGFFGNGFVLYVLVKTYHEKSAFQVYMINLAVADLLCVCTLPLRVAYYVHKGIWLFGDFLCRLSTYALYVNLYCSIFFMTAMSFFRCVAIVFPVQNISLVTQKKARLVCIAIWMFVILTSSPFLMANTYKDEKNNTKCFEPPQDNQAKNYVLILHYVSLFIGFIIPFITIIVCYTMIIFTLLKSSMKKNLSSRKRAIGMIIVVTAAFLVSFMPYHIQRTIHLHFLHNKTKPCDSILRMQKSVVITLSLAASNCCFDPLLYFFSGGNFRRRLSTIRKYSLSSMTYIPKKKTSLPQKGKDICKE
UniProtQ2NNR5
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL5645
IUPHARN/A
DrugBankN/A

Ligand

NameCHEMBL39586
Molecular formulaC26H32O5S
IUPAC name4-[(Z,4S,5R)-1-carboxy-4-hydroxy-12-phenyldodec-6-en-5-yl]sulfanylbenzoic acid
Molecular weight456.597
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP5.9
SynonymsN/A
Inchi KeyDDATXMJBFROJDU-OFODCZASSA-N
Inchi IDInChI=1S/C26H32O5S/c27-23(13-9-15-25(28)29)24(32-22-18-16-21(17-19-22)26(30)31)14-8-3-1-2-5-10-20-11-6-4-7-12-20/h4,6-8,11-12,14,16-19,23-24,27H,1-3,5,9-10,13,15H2,(H,28,29)(H,30,31)/b14-8-/t23-,24+/m0/s1
PubChem CID44285006
ChEMBLCHEMBL39586
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Ki19952.6 nMBioorg. Med. Chem. Lett., (1993) 3:8:1517ChEMBL

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