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Ligand

NameCHEMBL96504
Molecular formulaC21H23FN2O
IUPAC name2-[3-(4-fluorophenoxy)propyl]-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indole
Molecular weight338.426
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP4.0
SynonymsBDBM50130265
2-[3-(4-Fluoro-phenoxy)-propyl]-5-methyl-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole
Inchi KeyJALBJZIGFXCLKJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H23FN2O/c1-23-20-6-3-2-5-18(20)19-15-24(13-11-21(19)23)12-4-14-25-17-9-7-16(22)8-10-17/h2-3,5-10H,4,11-15H2,1H3
PubChem CID10382508
ChEMBLCHEMBL96504
IUPHARN/A
BindingDB50130265
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: 4
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GLASS IDNameUniProtGeneSpeciesLength
1460375-hydroxytryptamine receptor 2AP14842Htr2aRattus norvegicus (Rat)471
1460385-hydroxytryptamine receptor 2CP08909Htr2cRattus norvegicus (Rat)460
1460355-hydroxytryptamine receptor 5AP30966Htr5aMus musculus (Mouse)357
1460365-hydroxytryptamine receptor 5AP47898HTR5AHomo sapiens (Human)357

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