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Ligand

NameSCHEMBL603807
Molecular formulaC22H29FN6
IUPAC name5-(5-fluoro-4-methyl-1H-benzimidazol-2-yl)-4-methyl-N-[3-(1-methylpiperidin-4-yl)propyl]pyrimidin-2-amine
Molecular weight396.514
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP4.1
Synonyms[5-(5-Fluoro-4-methyl-1H-benzoimidazol-2-yl)-4-methyl-pyrimidin-2-yl]-[3-(1-methyl-piperidin-4-yl)-propyl]-amine
5-(5-Fluoro-4-methyl-1H-benzoimidazol-2-yl)-4-methyl-pyrimidin-2-yl[-3-(1-methyl-piperidin-4-yl)-propyl]-amine
CHEMBL3943309
AUWBEHSRDMALLO-UHFFFAOYSA-N
Inchi KeyAUWBEHSRDMALLO-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H29FN6/c1-14-18(23)6-7-19-20(14)28-21(27-19)17-13-25-22(26-15(17)2)24-10-4-5-16-8-11-29(3)12-9-16/h6-7,13,16H,4-5,8-12H2,1-3H3,(H,27,28)(H,24,25,26)
PubChem CID23650960
ChEMBLCHEMBL3943309
IUPHARN/A
BindingDBN/A
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
536376Histamine H4 receptorQ9H3N8HRH4Homo sapiens (Human)390

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