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Ligand

NameCHEMBL76002
Molecular formulaC16H25ClN4
IUPAC name1-[(4-chlorophenyl)methyl]-1-(4-pyrrolidin-1-ylbutyl)guanidine
Molecular weight308.854
Hydrogen bond acceptor2
Hydrogen bond donor2
XlogP2.6
SynonymsN/A
Inchi KeyAYQFYQSFUHBJIJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H25ClN4/c17-15-7-5-14(6-8-15)13-21(16(18)19)12-4-3-11-20-9-1-2-10-20/h5-8H,1-4,9-13H2,(H3,18,19)
PubChem CID10807460
ChEMBLCHEMBL76002
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
17687Histamine H3 receptorQ9JI35HRH3Cavia porcellus (Guinea pig)445

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