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Ligand

NameCHEMBL3582330
Molecular formulaC25H21FN10O
IUPAC name5-[(1R,3R)-3-[5-(5-fluoropyridin-2-yl)-1H-imidazol-2-yl]-1-(1-methylpyrazol-4-yl)-2,3,4,9-tetrahydropyrido[3,4-b]indol-1-yl]-1,3,4-oxadiazol-2-amine
Molecular weight496.51
Hydrogen bond acceptor9
Hydrogen bond donor4
XlogP0.9
SynonymsBDBM50091421
Inchi KeyBOKJQWGRYGDLOQ-KBMIEXCESA-N
Inchi IDInChI=1S/C25H21FN10O/c1-36-12-13(9-30-36)25(23-34-35-24(27)37-23)21-16(15-4-2-3-5-17(15)31-21)8-19(33-25)22-29-11-20(32-22)18-7-6-14(26)10-28-18/h2-7,9-12,19,31,33H,8H2,1H3,(H2,27,35)(H,29,32)/t19-,25-/m1/s1
PubChem CID122179470
ChEMBLCHEMBL3582330
IUPHARN/A
BindingDB50091421
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
466466Somatostatin receptor type 3P32745SSTR3Homo sapiens (Human)418

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