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Ligand

NameCHEMBL1084552
Molecular formulaC26H20ClF3N2O4
IUPAC name4-[(1S)-1-[[1-[[3-chloro-5-(trifluoromethoxy)phenyl]methyl]indole-7-carbonyl]amino]ethyl]benzoic acid
Molecular weight516.901
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP6.1
SynonymsBDBM50319840
(S)-4-(1-(1-(3-chloro-5-(trifluoromethoxy)benzyl)-1H-indole-7-carboxamido)ethyl)benzoic acid
Inchi KeyHQCZRLVYPNLNQN-HNNXBMFYSA-N
Inchi IDInChI=1S/C26H20ClF3N2O4/c1-15(17-5-7-19(8-6-17)25(34)35)31-24(33)22-4-2-3-18-9-10-32(23(18)22)14-16-11-20(27)13-21(12-16)36-26(28,29)30/h2-13,15H,14H2,1H3,(H,31,33)(H,34,35)/t15-/m0/s1
PubChem CID46890658
ChEMBLCHEMBL1084552
IUPHARN/A
BindingDB50319840
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 9
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
121274Prostacyclin receptorP43119PTGIRHomo sapiens (Human)386
121267Prostaglandin D2 receptorQ13258PTGDRHomo sapiens (Human)359
121269Prostaglandin D2 receptor 2Q9Y5Y4PTGDR2Homo sapiens (Human)395
121272Prostaglandin E2 receptor EP1 subtypeP34995PTGER1Homo sapiens (Human)402
121273Prostaglandin E2 receptor EP2 subtypeP43116PTGER2Homo sapiens (Human)358
121271Prostaglandin E2 receptor EP3 subtypeP43115PTGER3Homo sapiens (Human)390
121270Prostaglandin E2 receptor EP4 subtypeP35408PTGER4Homo sapiens (Human)488
121268Prostaglandin F2-alpha receptorP43088PTGFRHomo sapiens (Human)359
121275Thromboxane A2 receptorP21731TBXA2RHomo sapiens (Human)343

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