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Ligand

NameCHEMBL3355962
Molecular formulaC30H31F2N3O2S
IUPAC name2-[2-ethyl-6-fluoro-3-[1-[3-(4-fluorophenyl)sulfanylpropyl]piperidin-4-yl]indol-1-yl]pyridine-4-carboxylic acid
Molecular weight535.654
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP4.3
SynonymsBDBM50041088
Inchi KeyOVJKHLOCYYVIIT-UHFFFAOYSA-N
Inchi IDInChI=1S/C30H31F2N3O2S/c1-2-26-29(20-11-15-34(16-12-20)14-3-17-38-24-7-4-22(31)5-8-24)25-9-6-23(32)19-27(25)35(26)28-18-21(30(36)37)10-13-33-28/h4-10,13,18-20H,2-3,11-12,14-17H2,1H3,(H,36,37)
PubChem CID118721202
ChEMBLCHEMBL3355962
IUPHARN/A
BindingDB50041088
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
451612C-C chemokine receptor type 3P51677CCR3Homo sapiens (Human)355
451613C-C chemokine receptor type 3O54814Ccr3Rattus norvegicus (Rat)359
451614Probable C-C chemokine receptor type 3P51678Ccr3Mus musculus (Mouse)359

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