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Ligand

NameCHEMBL372724
Molecular formulaC23H24ClN3O5
IUPAC namemethyl 2-[[2-[4-(6-chloro-2-oxo-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]acetyl]amino]benzoate
Molecular weight457.911
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP3.8
SynonymsBDBM50163517
SCHEMBL3377763
2-{2-[4-(6-Chloro-2-oxo-4H-benzo[d][1,3]oxazin-1-yl)-piperidin-1-yl]-acetylamino}-benzoic acid methyl ester
Inchi KeyBVYJNIUMOSPQEW-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H24ClN3O5/c1-31-22(29)18-4-2-3-5-19(18)25-21(28)13-26-10-8-17(9-11-26)27-20-7-6-16(24)12-15(20)14-32-23(27)30/h2-7,12,17H,8-11,13-14H2,1H3,(H,25,28)
PubChem CID9981549
ChEMBLCHEMBL372724
IUPHARN/A
BindingDB50163517
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
34200Neuropeptide Y receptor type 5Q63634Npy5rRattus norvegicus (Rat)445

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