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Ligand

NameBDBM50070217
Molecular formulaC15H17BrN4O3
IUPAC name3-(3-bromo-4-methoxyphenyl)-N-[2-(1H-imidazol-5-yl)ethyl]-2-nitrosopropanamide
Molecular weight381.23
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP1.9
Synonyms3-(3-Bromo-4-methoxy-phenyl)-2-[(E)-hydroxyimino]-N-[2-(1H-imidazol-4-yl)-ethyl]-propionamide
Inchi KeyADPGWZRMOCDDKN-UHFFFAOYSA-N
Inchi IDInChI=1S/C15H17BrN4O3/c1-23-14-3-2-10(6-12(14)16)7-13(20-22)15(21)18-5-4-11-8-17-9-19-11/h2-3,6,8-9,13H,4-5,7H2,1H3,(H,17,19)(H,18,21)
PubChem CID53637393
ChEMBLN/A
IUPHARN/A
BindingDB50070217
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
2936Histamine H3 receptorQ9QYN8Hrh3Rattus norvegicus (Rat)445
2937Histamine H3 receptorQ9JI35HRH3Cavia porcellus (Guinea pig)445

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