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Ligand

NameCHEMBL14538
Molecular formulaC21H24FN3O2
IUPAC name2-[3-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]propoxy]aniline
Molecular weight369.44
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP3.8
SynonymsBDBM50034047
SCHEMBL5995122
2-{3-[4-(6-Fluoro-benzo[d]isoxazol-3-yl)-piperidin-1-yl]-propoxy}-phenylamine
Inchi KeyADTNCVXMQJPBHL-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H24FN3O2/c22-16-6-7-17-20(14-16)27-24-21(17)15-8-11-25(12-9-15)10-3-13-26-19-5-2-1-4-18(19)23/h1-2,4-7,14-15H,3,8-13,23H2
PubChem CID10317012
ChEMBLCHEMBL14538
IUPHARN/A
BindingDB50034047
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
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GLASS IDNameUniProtGeneSpeciesLength
3071D(2) dopamine receptorP61169Drd2Rattus norvegicus (Rat)444

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