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Ligand

NameCHEMBL3286559
Molecular formulaC15H18N4
IUPAC name2-benzyl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepin-4-amine
Molecular weight254.337
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP1.7
SynonymsBDBM50019661
Inchi KeyAKAGBZJKYPRLQD-UHFFFAOYSA-N
Inchi IDInChI=1S/C15H18N4/c16-15-12-6-8-17-9-7-13(12)18-14(19-15)10-11-4-2-1-3-5-11/h1-5,17H,6-10H2,(H2,16,18,19)
PubChem CID90644510
ChEMBLCHEMBL3286559
IUPHARN/A
BindingDB50019661
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
73755-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458

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