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Ligand

NameBDBM85395
Molecular formulaC30H31ClN2O4
IUPAC name(Z)-N-[(7aR)-3-(cyclopropylmethyl)-9-methoxy-7-oxo-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-4a-yl]-3-(4-chlorophenyl)prop-2-enamide
Molecular weight519.038
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP5.0
SynonymsN/A
Inchi KeyLZSMGMMAKBCSRL-IWRUZLQFSA-N
Inchi IDInChI=1S/C30H31ClN2O4/c1-36-23-10-7-20-16-24-30(32-25(35)11-6-18-4-8-21(31)9-5-18)13-12-22(34)28-29(30,26(20)27(23)37-28)14-15-33(24)17-19-2-3-19/h4-11,19,24,28H,2-3,12-17H2,1H3,(H,32,35)/b11-6-/t24?,28-,29?,30?/m0/s1
PubChem CID57340107
ChEMBLN/A
IUPHARN/A
BindingDB85395
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
200316Kappa-type opioid receptorQ2KIP6OPRK1Bos taurus (Bovine)380
200317Mu-type opioid receptorP79350OPRM1Bos taurus (Bovine)401

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