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Ligand

NameCHEMBL3355952
Molecular formulaC26H30F2N2O2S
IUPAC name2-[2-ethyl-6-fluoro-3-[1-[3-(4-fluorophenyl)sulfanylpropyl]piperidin-4-yl]indol-1-yl]acetic acid
Molecular weight472.595
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP3.6
SynonymsSCHEMBL1107157
BDBM50041191
Inchi KeyMPXYNWUUGMMVRW-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H30F2N2O2S/c1-2-23-26(22-9-6-20(28)16-24(22)30(23)17-25(31)32)18-10-13-29(14-11-18)12-3-15-33-21-7-4-19(27)5-8-21/h4-9,16,18H,2-3,10-15,17H2,1H3,(H,31,32)
PubChem CID24937215
ChEMBLCHEMBL3355952
IUPHARN/A
BindingDB50041191
DrugBankN/A

Structure

SDF download

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

Known GPCRs

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Total entries: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
450005C-C chemokine receptor type 3O54814Ccr3Rattus norvegicus (Rat)359
450006C-C chemokine receptor type 3P51677CCR3Homo sapiens (Human)355
450004Probable C-C chemokine receptor type 3P51678Ccr3Mus musculus (Mouse)359

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