COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK252540
Chemical Name: 2-(3,4-dimethylphenyl)-2-oxoethyl2-(3-nitrophenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate
Smiles: O=C(c1ccc2c(c1)C(=O)N(C2=O)c1cccc(c1)[N+](=O)[O-])OCC(=O)c1ccc(c(c1)C)C

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Molecular Weight: 458.43
Empirical Formula: C25H18N2O7

Physical State: Dry powder
Available Amount: 375 mg

Lipinsky:
logP: 4.506
Rotatable bonds: 5
H-donors: 0
H-acceptors: 7
PSA: 126
Number of rings: 4

     

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