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Ligand

NameCHEMBL89448
Molecular formulaC16H24N4O2
IUPAC nameN-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N'-(1,4,5,6-tetrahydropyrimidin-2-yl)propane-1,3-diamine
Molecular weight304.394
Hydrogen bond acceptor4
Hydrogen bond donor3
XlogP1.4
SynonymsBDBM50403521
Inchi KeyACOPJGUABVTKCV-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H24N4O2/c1-2-6-15-14(5-1)21-12-13(22-15)11-17-7-3-8-18-16-19-9-4-10-20-16/h1-2,5-6,13,17H,3-4,7-12H2,(H2,18,19,20)
PubChem CID44322821
ChEMBLCHEMBL89448
IUPHARN/A
BindingDB50403521
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
17525-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
17535-hydroxytryptamine receptor 1DP28221HTR1DHomo sapiens (Human)377

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