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Ligand

NameCHEMBL3883525
Molecular formulaC24H28N2O4
IUPAC namemethyl (2R)-2-[[2-(4-cyanophenyl)acetyl]amino]-2-[4-(2-methylpentoxy)phenyl]acetate
Molecular weight408.498
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.7
SynonymsBDBM50209616
Inchi KeyMCYNFUYXISWWRG-IRCUZVAFSA-N
Inchi IDInChI=1S/C24H28N2O4/c1-4-5-17(2)16-30-21-12-10-20(11-13-21)23(24(28)29-3)26-22(27)14-18-6-8-19(15-25)9-7-18/h6-13,17,23H,4-5,14,16H2,1-3H3,(H,26,27)/t17?,23-/m1/s1
PubChem CID134130159
ChEMBLCHEMBL3883525
IUPHARN/A
BindingDB50209616
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
550418Probable G-protein coupled receptor 88Q9GZN0GPR88Homo sapiens (Human)384

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