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Ligand

NameCHEMBL3427239
Molecular formulaC26H33NO2
IUPAC namemethyl 1-[4-[4-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]phenyl]phenyl]cyclopentane-1-carboxylate
Molecular weight391.555
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP6.0
SynonymsSCHEMBL15874957
ABMIIPGFGQPNJZ-HXUWFJFHSA-N
BDBM50088132
(R)-Methyl 1-(4'-(2-(2-Methylpyrrolidin-1-yl)ethyl)biphenyl-4-yl)cyclopentanecarboxylate
Inchi KeyABMIIPGFGQPNJZ-HXUWFJFHSA-N
Inchi IDInChI=1S/C26H33NO2/c1-20-6-5-18-27(20)19-15-21-7-9-22(10-8-21)23-11-13-24(14-12-23)26(25(28)29-2)16-3-4-17-26/h7-14,20H,3-6,15-19H2,1-2H3/t20-/m1/s1
PubChem CID78320398
ChEMBLCHEMBL3427239
IUPHARN/A
BindingDB50088132
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
441706Histamine H3 receptorQ9Y5N1HRH3Homo sapiens (Human)445

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