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Ligand

NameSCHEMBL15875079
Molecular formulaC30H40N2O3
IUPAC namemethyl 4-[[1-[4-[4-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]phenyl]phenyl]cyclopentanecarbonyl]amino]butanoate
Molecular weight476.661
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP5.6
SynonymsAHNFQSQROYKANS-HSZRJFAPSA-N
BDBM235921
US9365511, 16
(R)-Methyl 4-(1-(4'-(2-(2-Methylpyrrolidin-1-yl)ethyl)biphenyl-4-yl)cyclopentanecarboxamido)butanoate
Inchi KeyAHNFQSQROYKANS-HSZRJFAPSA-N
Inchi IDInChI=1S/C30H40N2O3/c1-23-7-6-21-32(23)22-17-24-9-11-25(12-10-24)26-13-15-27(16-14-26)30(18-3-4-19-30)29(34)31-20-5-8-28(33)35-2/h9-16,23H,3-8,17-22H2,1-2H3,(H,31,34)/t23-/m1/s1
PubChem CID78320095
ChEMBLN/A
IUPHARN/A
BindingDB235921
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
557439Histamine H3 receptorQ9Y5N1HRH3Homo sapiens (Human)445

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