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Ligand

NameCHEMBL94940
Molecular formulaC21H24N2
IUPAC name1-[(3,4-dimethylphenyl)methyl]-6-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Molecular weight304.437
Hydrogen bond acceptor1
Hydrogen bond donor2
XlogP4.6
Synonyms1-(3,4-Dimethylbenzyl)-6-methyl-1,2,3,4-tetrahydro-beta-carboline
Inchi KeyDTCPBMNVODXPJH-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H24N2/c1-13-4-7-19-18(10-13)17-8-9-22-20(21(17)23-19)12-16-6-5-14(2)15(3)11-16/h4-7,10-11,20,22-23H,8-9,12H2,1-3H3
PubChem CID10709661
ChEMBLCHEMBL94940
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
682025-hydroxytryptamine receptor 2BP30994Htr2bRattus norvegicus (Rat)479

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