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Ligand

NameCHEMBL94613
Molecular formulaC20H19F3N2
IUPAC name6-methyl-1-[[3-(trifluoromethyl)phenyl]methyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Molecular weight344.381
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP4.7
Synonyms1-[3-(Trifluoromethyl)benzyl]-6-methyl-1,2,3,4-tetrahydro-beta-carboline
Inchi KeyFJUNIBZNKJSJJJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H19F3N2/c1-12-5-6-17-16(9-12)15-7-8-24-18(19(15)25-17)11-13-3-2-4-14(10-13)20(21,22)23/h2-6,9-10,18,24-25H,7-8,11H2,1H3
PubChem CID10593541
ChEMBLCHEMBL94613
IUPHARN/A
BindingDBN/A
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
800835-hydroxytryptamine receptor 2BP30994Htr2bRattus norvegicus (Rat)479

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