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Ligand

NameCHEMBL289936
Molecular formulaC20H20N4O
IUPAC name2-[5-[(3-benzyl-1,2,4-oxadiazol-5-yl)methyl]-1H-indol-3-yl]ethanamine
Molecular weight332.407
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP3.5
SynonymsSCHEMBL8785674
BDBM50406787
5-[(3-Benzyl-1,2,4-oxadiazol-5-yl)methyl]-1H-indole-3-(ethanamine)
Inchi KeyNHIRYTRRCNWYFT-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H20N4O/c21-9-8-16-13-22-18-7-6-15(10-17(16)18)12-20-23-19(24-25-20)11-14-4-2-1-3-5-14/h1-7,10,13,22H,8-9,11-12,21H2
PubChem CID11724329
ChEMBLCHEMBL289936
IUPHARN/A
BindingDB50406787
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
2232955-hydroxytryptamine receptor 1DP79400HTR1DSus scrofa (Pig)291

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