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Ligand

NameCHEMBL3355939
Molecular formulaC23H26F2N2OS
IUPAC name[6-fluoro-3-[1-[3-(4-fluorophenyl)sulfanylpropyl]piperidin-4-yl]-1H-indol-2-yl]methanol
Molecular weight416.531
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP4.5
SynonymsBDBM50041181
Inchi KeyDTLONXZATYJNCF-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H26F2N2OS/c24-17-2-5-19(6-3-17)29-13-1-10-27-11-8-16(9-12-27)23-20-7-4-18(25)14-21(20)26-22(23)15-28/h2-7,14,16,26,28H,1,8-13,15H2
PubChem CID118721190
ChEMBLCHEMBL3355939
IUPHARN/A
BindingDB50041181
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
444379C-C chemokine receptor type 3O54814Ccr3Rattus norvegicus (Rat)359
444380C-C chemokine receptor type 3P51677CCR3Homo sapiens (Human)355
444381Probable C-C chemokine receptor type 3P51678Ccr3Mus musculus (Mouse)359

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