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Ligand

NameCHEMBL413554
Molecular formulaC20H21FN2O
IUPAC name2-(1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinolin-3-yl)-1-(4-fluorophenyl)ethanone
Molecular weight324.399
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP3.8
SynonymsBDBM50162860
1-(4-Fluoro-phenyl)-2-(1,2,4,4a,5,6-hexahydro-pyrazino[1,2-a]quinolin-3-yl)-ethanone
Inchi KeyAHBVUZZQOFAMJW-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H21FN2O/c21-17-8-5-16(6-9-17)20(24)14-22-11-12-23-18(13-22)10-7-15-3-1-2-4-19(15)23/h1-6,8-9,18H,7,10-14H2
PubChem CID44390226
ChEMBLCHEMBL413554
IUPHARN/A
BindingDB50162860
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
5418D(3) dopamine receptorP19020Drd3Rattus norvegicus (Rat)446

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