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Ligand

NameCHEMBL49624
Molecular formulaC30H42N2O5
IUPAC name(3S,6S)-1,3-dimethyl-4-octyl-6-[[4-(3,4,5-trimethoxyphenyl)phenyl]methyl]piperazine-2,5-dione
Molecular weight510.675
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP6.4
SynonymsBDBM50142676
SCHEMBL6140944
(3S,6S)-1,3-Dimethyl-4-octyl-6-(3'',4'',5''-trimethoxy-biphenyl-4-ylmethyl)-piperazine-2,5-dione
Inchi KeyKKWAMGGZQCLTJI-OFVILXPXSA-N
Inchi IDInChI=1S/C30H42N2O5/c1-7-8-9-10-11-12-17-32-21(2)29(33)31(3)25(30(32)34)18-22-13-15-23(16-14-22)24-19-26(35-4)28(37-6)27(20-24)36-5/h13-16,19-21,25H,7-12,17-18H2,1-6H3/t21-,25-/m0/s1
PubChem CID10164519
ChEMBLCHEMBL49624
IUPHARN/A
BindingDB50142676
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
171567Follicle-stimulating hormone receptorP23945FSHRHomo sapiens (Human)695

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