COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK299899
Chemical Name: 5-[(3-nitrophenyl)carbonyl]-2-{3-[(1Z)-3-oxo-3-phenylprop-1-en-1-yl]phenyl}-1H-isoindole-1,3(2H)-dione
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])c1ccc2c(c1)C(=O)N(C2=O)c1cccc(c1)/C=C\C(=O)c1ccccc1

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Molecular Weight: 502.48
Empirical Formula: C30H18N2O6

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 4.987
Rotatable bonds: 4
H-donors: 0
H-acceptors: 6
PSA: 117
Number of rings: 5

     

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