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Ligand

NameCHEMBL3601785
Molecular formulaC17H20BrN7O3
IUPAC nameN-[(2S)-3-(5-bromo-1-methylimidazol-4-yl)-1-[(2S)-2-carbamoylpyrrolidin-1-yl]-1-oxopropan-2-yl]pyrazine-2-carboxamide
Molecular weight450.297
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP-0.5
SynonymsBDBM50109022
Inchi KeyJZEDEIDXZNCULP-AAEUAGOBSA-N
Inchi IDInChI=1S/C17H20BrN7O3/c1-24-9-22-10(14(24)18)7-11(23-16(27)12-8-20-4-5-21-12)17(28)25-6-2-3-13(25)15(19)26/h4-5,8-9,11,13H,2-3,6-7H2,1H3,(H2,19,26)(H,23,27)/t11-,13-/m0/s1
PubChem CID122185157
ChEMBLCHEMBL3601785
IUPHARN/A
BindingDB50109022
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
483095Thyrotropin-releasing hormone receptorP21761TrhrMus musculus (Mouse)393

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