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Ligand

NameCHEMBL3774791
Molecular formulaC26H28N4O
IUPAC name(1R,3R)-3-[5-(4-methylphenyl)-1H-imidazol-2-yl]-1-(oxan-4-yl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Molecular weight412.537
Hydrogen bond acceptor3
Hydrogen bond donor3
XlogP3.8
SynonymsBDBM50154530
Inchi KeyBPXANCDAUIMICT-ISKFKSNPSA-N
Inchi IDInChI=1S/C26H28N4O/c1-16-6-8-17(9-7-16)23-15-27-26(30-23)22-14-20-19-4-2-3-5-21(19)28-25(20)24(29-22)18-10-12-31-13-11-18/h2-9,15,18,22,24,28-29H,10-14H2,1H3,(H,27,30)/t22-,24-/m1/s1
PubChem CID127031456
ChEMBLCHEMBL3774791
IUPHARN/A
BindingDB50154530
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
522450Somatostatin receptor type 3P32745SSTR3Homo sapiens (Human)418

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