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Ligand

NameCHEMBL3355941
Molecular formulaC25H28F2N2O2S
IUPAC nameethyl 6-fluoro-3-[1-[3-(4-fluorophenyl)sulfanylpropyl]piperidin-4-yl]-1H-indole-2-carboxylate
Molecular weight458.568
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP5.9
SynonymsBDBM50041183
Inchi KeyZDNRSFQTWFIIDN-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H28F2N2O2S/c1-2-31-25(30)24-23(21-9-6-19(27)16-22(21)28-24)17-10-13-29(14-11-17)12-3-15-32-20-7-4-18(26)5-8-20/h4-9,16-17,28H,2-3,10-15H2,1H3
PubChem CID118721192
ChEMBLCHEMBL3355941
IUPHARN/A
BindingDB50041183
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
458569C-C chemokine receptor type 3P51677CCR3Homo sapiens (Human)355
458570C-C chemokine receptor type 3O54814Ccr3Rattus norvegicus (Rat)359

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