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Ligand

NameCHEMBL1079552
Molecular formulaC13H23N3O2
IUPAC name3-(1H-imidazol-5-yl)propyl N-hexan-2-ylcarbamate
Molecular weight253.346
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP2.7
SynonymsBDBM50074072
(1-Methyl-pentyl)-carbamic acid 3-(1H-imidazol-4-yl)-propyl ester; compound with (E)-but-2-enedioic acid
Inchi KeyBOAJEIFQZOFOCK-UHFFFAOYSA-N
Inchi IDInChI=1S/C13H23N3O2/c1-3-4-6-11(2)16-13(17)18-8-5-7-12-9-14-10-15-12/h9-11H,3-8H2,1-2H3,(H,14,15)(H,16,17)
PubChem CID10243990
ChEMBLCHEMBL1079552
IUPHARN/A
BindingDB50074072
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
28593Histamine H3 receptorQ9QYN8Hrh3Rattus norvegicus (Rat)445
28594Histamine H3 receptorQ9Y5N1HRH3Homo sapiens (Human)445
28592Histamine H4 receptorQ9H3N8HRH4Homo sapiens (Human)390

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