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Ligand

NameCHEMBL281044
Molecular formulaC34H30N4O6
IUPAC nameN-[[5-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)piperidine-1-carbonyl]-1-benzofuran-2-yl]methyl]-2-(1-oxoisoquinolin-2-yl)acetamide
Molecular weight590.636
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP3.8
SynonymsBDBM50219764
Inchi KeyAQFSRNPFFXJBQW-UHFFFAOYSA-N
Inchi IDInChI=1S/C34H30N4O6/c39-31(20-37-14-11-22-5-1-3-7-28(22)33(37)41)35-19-27-18-25-17-23(9-10-30(25)44-27)32(40)36-15-12-26(13-16-36)38-29-8-4-2-6-24(29)21-43-34(38)42/h1-11,14,17-18,26H,12-13,15-16,19-21H2,(H,35,39)
PubChem CID44279909
ChEMBLCHEMBL281044
IUPHARN/A
BindingDB50219764
DrugBankN/A

Structure

SDF download

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

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
11657Oxytocin receptorP30559OXTRHomo sapiens (Human)389

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