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Ligand

NameCHEMBL99452
Molecular formulaC17H23N5O2
IUPAC name3-cyclopropyl-N-[(4-methylpiperazin-1-yl)methyl]-2-oxobenzimidazole-1-carboxamide
Molecular weight329.404
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP1.6
SynonymsBDBM50079308
3-Cyclopropyl-2-oxo-2,3-dihydro-benzoimidazole-1-carboxylic acid (4-methyl-piperazin-1-ylmethyl)-amide
Inchi KeyCLWVDIOYXBAMQX-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H23N5O2/c1-19-8-10-20(11-9-19)12-18-16(23)22-15-5-3-2-4-14(15)21(17(22)24)13-6-7-13/h2-5,13H,6-12H2,1H3,(H,18,23)
PubChem CID10687803
ChEMBLCHEMBL99452
IUPHARN/A
BindingDB50079308
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
450745-hydroxytryptamine receptor 4O70528HTR4Cavia porcellus (Guinea pig)388

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