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Ligand

NameCHEMBL45976
Molecular formulaC29H40N2O5
IUPAC name(3S)-4-methyl-1-octyl-3-[[4-(3,4,5-trimethoxyphenyl)phenyl]methyl]piperazine-2,5-dione
Molecular weight496.648
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP6.0
SynonymsBDBM50142681
SCHEMBL6140841
(S)-4-Methyl-1-octyl-3-(3'',4'',5''-trimethoxy-biphenyl-4-ylmethyl)-piperazine-2,5-dione
Inchi KeyVZKJOGGFHYWYMN-DEOSSOPVSA-N
Inchi IDInChI=1S/C29H40N2O5/c1-6-7-8-9-10-11-16-31-20-27(32)30(2)24(29(31)33)17-21-12-14-22(15-13-21)23-18-25(34-3)28(36-5)26(19-23)35-4/h12-15,18-19,24H,6-11,16-17,20H2,1-5H3/t24-/m0/s1
PubChem CID10185204
ChEMBLCHEMBL45976
IUPHARN/A
BindingDB50142681
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
367991Follicle-stimulating hormone receptorP23945FSHRHomo sapiens (Human)695

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