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Ligand

NameCHEMBL1081720
Molecular formulaC14H25N3O2
IUPAC name3-(1H-imidazol-5-yl)propyl N-(5-methylhexan-2-yl)carbamate
Molecular weight267.373
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP2.9
Synonyms(R,S)-3-(1H-imidazol-4-yl)propyl 5-methylhexan-2-ylcarbamate
BDBM50311781
1,4-Dimethylpentylcarbamic acid 3-(1H-imidazole-4-yl)propyl ester
Inchi KeyAIPXZCQJTXUFHL-UHFFFAOYSA-N
Inchi IDInChI=1S/C14H25N3O2/c1-11(2)6-7-12(3)17-14(18)19-8-4-5-13-9-15-10-16-13/h9-12H,4-8H2,1-3H3,(H,15,16)(H,17,18)
PubChem CID11794363
ChEMBLCHEMBL1081720
IUPHARN/A
BindingDB50311781
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
6441Histamine H3 receptorQ9Y5N1HRH3Homo sapiens (Human)445

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