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Ligand

NameSCHEMBL3555280
Molecular formulaC13H16N2O
IUPAC name(3R,11aR)-3-methyl-1,2,3,4,11,11a-hexahydropyrazino[1,2-b]isoquinolin-6-one
Molecular weight216.284
Hydrogen bond acceptor2
Hydrogen bond donor1
XlogP1.3
Synonyms(3R,11aR)-1,2,3,4,11,11a-hexahydro-3-methyl-pyrazino[1,2-b]isoquinolin-6-one
CHEMBL2396668
AELIJLHYRIRWPT-MWLCHTKSSA-N
(3R, 11aR)-1,2,3,4,11,11a-Hexahydro-3-methyl-pyrazino[1,2-b]isoquinolin-6-one
Inchi KeyAELIJLHYRIRWPT-MWLCHTKSSA-N
Inchi IDInChI=1S/C13H16N2O/c1-9-8-15-11(7-14-9)6-10-4-2-3-5-12(10)13(15)16/h2-5,9,11,14H,6-8H2,1H3/t9-,11-/m1/s1
PubChem CID58911681
ChEMBLCHEMBL2396668
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
36095-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
36105-hydroxytryptamine receptor 2BP41595HTR2BHomo sapiens (Human)481
36085-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458

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