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Ligand

NameCHEMBL79496
Molecular formulaC19H20N2O2
IUPAC nameN,N-dimethyl-3-oxa-2-azatetracyclo[12.4.0.02,6.07,12]octadeca-1(18),7,9,11,14,16-hexaene-4-carboxamide
Molecular weight308.381
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP3.3
SynonymsBDBM50403961
N,N-Dimethyl-2,3,3a,8-tetrahydro-1-oxa-12b-azadibenzo[e,h]azulene-2-carboxamide
Inchi KeyCIIWLVZNBDXUIV-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H20N2O2/c1-20(2)19(22)18-12-17-15-9-5-3-7-13(15)11-14-8-4-6-10-16(14)21(17)23-18/h3-10,17-18H,11-12H2,1-2H3
PubChem CID44461799
ChEMBLCHEMBL79496
IUPHARN/A
BindingDB50403961
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
427335-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
427345-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458
427355-hydroxytryptamine receptor 2CP08909Htr2cRattus norvegicus (Rat)460
42732Histamine H1 receptorP35367HRH1Homo sapiens (Human)487

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