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Ligand

NameCHEMBL2437432
Molecular formulaC28H31FN8O2
IUPAC name1-[1-[1-[(2-aminopyridin-4-yl)methyl]piperidine-4-carbonyl]piperidin-4-yl]-5-fluoro-3-pyrimidin-2-ylbenzimidazol-2-one
Molecular weight530.608
Hydrogen bond acceptor8
Hydrogen bond donor1
XlogP1.8
SynonymsBDBM50441653
Inchi KeyASYPSYLJDLVBFQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H31FN8O2/c29-21-2-3-23-24(17-21)37(27-32-9-1-10-33-27)28(39)36(23)22-7-14-35(15-8-22)26(38)20-5-12-34(13-6-20)18-19-4-11-31-25(30)16-19/h1-4,9-11,16-17,20,22H,5-8,12-15,18H2,(H2,30,31)
PubChem CID72375119
ChEMBLCHEMBL2437432
IUPHARN/A
BindingDB50441653
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
13735Histamine H3 receptorQ9JI35HRH3Cavia porcellus (Guinea pig)445

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