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Ligand

NameSMR000092791
Molecular formulaC21H16BrN3O3
IUPAC name5-bromo-2-methoxy-3-methyl-N-[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]benzamide
Molecular weight438.281
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.6
SynonymsAKOS000457830
MolPort-001-630-067
5-bromo-2-methoxy-3-methyl-N-(3-[1,3]oxazolo[4,5-b]pyridin-2-ylphenyl)benzamide
cid_1511511
ZINC1431966
[ Show all ]
Inchi KeyABUMZSAITJVKFU-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H16BrN3O3/c1-12-9-14(22)11-16(18(12)27-2)20(26)24-15-6-3-5-13(10-15)21-25-19-17(28-21)7-4-8-23-19/h3-11H,1-2H3,(H,24,26)
PubChem CID1511511
ChEMBLN/A
IUPHARN/A
BindingDB30936
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
11955-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422

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