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Ligand

NameCHEMBL3937066
Molecular formulaC23H29NO2
IUPAC namemethyl 3-[4-[4-[2-[(2S)-2-methylpyrrolidin-1-yl]ethyl]phenyl]phenyl]propanoate
Molecular weight351.49
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP4.9
SynonymsN/A
Inchi KeyAAZRUJBRNBEHMO-SFHVURJKSA-N
Inchi IDInChI=1S/C23H29NO2/c1-18-4-3-16-24(18)17-15-20-7-12-22(13-8-20)21-10-5-19(6-11-21)9-14-23(25)26-2/h5-8,10-13,18H,3-4,9,14-17H2,1-2H3/t18-/m0/s1
PubChem CID134149385
ChEMBLCHEMBL3937066
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
547910Histamine H3 receptorQ9Y5N1HRH3Homo sapiens (Human)445

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