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Ligand

NameCHEMBL99578
Molecular formulaC16H23N5O2
IUPAC name3-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]-2-oxobenzimidazole-1-carboxamide
Molecular weight317.393
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP0.9
Synonyms3-Methyl-2-oxo-2,3-dihydro-benzoimidazole-1-carboxylic acid [2-(4-methyl-piperazin-1-yl)-ethyl]-amide
BDBM50079314
3-Methyl-N-[2-(4-methylpiperazino)ethyl]-2-oxo-2,3-dihydro-1H-benzimidazole-1-carboxamide
Inchi KeyCZHCUQQIVUYRAS-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H23N5O2/c1-18-9-11-20(12-10-18)8-7-17-15(22)21-14-6-4-3-5-13(14)19(2)16(21)23/h3-6H,7-12H2,1-2H3,(H,17,22)
PubChem CID10543526
ChEMBLCHEMBL99578
IUPHARN/A
BindingDB50079314
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
542955-hydroxytryptamine receptor 4O70528HTR4Cavia porcellus (Guinea pig)388

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