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Chemical structure of APG-115

GC35367

APG-115

APG-115 (APG-115) is an orally active MDM2 protein inhibitor binding to MDM2 protein with IC50 and Ki values of 3·8 nM and 1 nM, respectively· APG-115 blocks the interaction of MDM2 and p53 and induces cell-cycle arrest and apoptosis in a p53-dependent manner

ChemicalCAS1818393-16-6MW642.59FormulaC34H38Cl2FN3O4
CAS number
1818393-16-6
Molecular weight
642.59
Formula
C34H38Cl2FN3O4
Solubility
Soluble in DMSO
InChIKey
YJCZPJQGFSSFOL-MNZPCBJKSA-N
Catalogue number
GC35367
Brand
GLPBIO
Computed properties PubChem CID 91972012 · XLogP 3.6 · TPSA 98.7 Ų · H-bond donors 3
XLogP
3.6
TPSA
98.7 Ų
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
44

SMILES CCN1[C@H]([C@@H]([C@]2(C13CCCCC3)C4=C(C=C(C=C4)Cl)NC2=O)C5=C(C(=CC=C5)Cl)F)C(=O)NC67CCC(CC6)(CC7)C(=O)O

Computed descriptors from PubChem (CID 91972012), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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