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Ligand

NameCHEMBL1095741
Molecular formulaC22H28N6
IUPAC name5-(azepan-1-yl)-7-benzyl-2,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridin-1-amine
Molecular weight376.508
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP3.5
Synonyms5-(azepan-1-yl)-7-benzyl-6,7,8,9-tetrahydro-3H-pyrazolo[3,4-c][2,7]naphthyridin-1-amine
BDBM50317450
Inchi KeyXHISSIJKGVHSNQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H28N6/c23-20-19-17-10-13-27(14-16-8-4-3-5-9-16)15-18(17)22(24-21(19)26-25-20)28-11-6-1-2-7-12-28/h3-5,8-9H,1-2,6-7,10-15H2,(H3,23,24,25,26)
PubChem CID46887766
ChEMBLCHEMBL1095741
IUPHARN/A
BindingDB50317450
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
391892Bombesin receptor subtype-3P32247BRS3Homo sapiens (Human)399
391893Bombesin receptor subtype-3Q8K418Brs3Rattus norvegicus (Rat)399

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