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Ligand

NameCHEMBL2147917
Molecular formulaC25H26N2O3
IUPAC name(1R,14S,15R)-8-methoxy-25-methyl-4,25-diazahexacyclo[13.7.3.01,14.03,12.05,10.017,22]pentacosa-3(12),4,6,8,10,17(22),18,20-octaene-14,20-diol
Molecular weight402.494
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP3.4
SynonymsBDBM50391604
CHEMBL2220015
Inchi KeyAVKJLWDSLYEXEQ-UBFVSLLYSA-N
Inchi IDInChI=1S/C25H26N2O3/c1-27-8-7-24-14-22-17(9-16-10-19(30-2)5-6-21(16)26-22)13-25(24,29)23(27)11-15-3-4-18(28)12-20(15)24/h3-6,9-10,12,23,28-29H,7-8,11,13-14H2,1-2H3/t23-,24-,25-/m1/s1
PubChem CID71461876
ChEMBLN/A
IUPHARN/A
BindingDB50391604
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
15356Delta-type opioid receptorP32300Oprd1Mus musculus (Mouse)372
15357Kappa-type opioid receptorP41144OPRK1Cavia porcellus (Guinea pig)380
15358Mu-type opioid receptorP42866Oprm1Mus musculus (Mouse)398

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