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Ligand

NameCHEMBL1270474
Molecular formulaC27H30N2O2
IUPAC name(1R,14S,15R)-25-(2-methylpropyl)-4,25-diazahexacyclo[13.7.3.01,14.03,12.05,10.017,22]pentacosa-3,5,7,9,11,17(22),18,20-octaene-14,20-diol
Molecular weight414.549
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP4.7
SynonymsBDBM50329099
Inchi KeyBOEFEPHOQDRYQO-ZONZVBGPSA-N
Inchi IDInChI=1S/C27H30N2O2/c1-17(2)16-29-10-9-26-15-24-20(11-19-5-3-4-6-23(19)28-24)14-27(26,31)25(29)12-18-7-8-21(30)13-22(18)26/h3-8,11,13,17,25,30-31H,9-10,12,14-16H2,1-2H3/t25-,26-,27-/m1/s1
PubChem CID52943343
ChEMBLCHEMBL1270474
IUPHARN/A
BindingDB50329099
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
28715Delta-type opioid receptorP32300Oprd1Mus musculus (Mouse)372
28714Kappa-type opioid receptorP41144OPRK1Cavia porcellus (Guinea pig)380
28716Mu-type opioid receptorP42866Oprm1Mus musculus (Mouse)398

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