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Ligand

NameCHEMBL3355936
Molecular formulaC25H31FN2OS
IUPAC name2-ethyl-6-fluoro-3-[1-[3-(4-methoxyphenyl)sulfanylpropyl]piperidin-4-yl]-1H-indole
Molecular weight426.594
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP6.1
SynonymsBDBM50041166
Inchi KeyVGSYCJKOMDSIPP-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H31FN2OS/c1-3-23-25(22-10-5-19(26)17-24(22)27-23)18-11-14-28(15-12-18)13-4-16-30-21-8-6-20(29-2)7-9-21/h5-10,17-18,27H,3-4,11-16H2,1-2H3
PubChem CID118721187
ChEMBLCHEMBL3355936
IUPHARN/A
BindingDB50041166
DrugBankN/A

Structure

SDF download

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

Known GPCRs

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Total entries: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
455802C-C chemokine receptor type 3O54814Ccr3Rattus norvegicus (Rat)359
455804C-C chemokine receptor type 3P51677CCR3Homo sapiens (Human)355
455803Probable C-C chemokine receptor type 3P51678Ccr3Mus musculus (Mouse)359

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