COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK269501
Chemical Name: 2-(4-methyl-3-nitrophenyl)-2-oxoethyl(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)acetate
Smiles: O=C(CN1C(=O)C2C(C1=O)C1CC2C=C1)OCC(=O)c1ccc(c(c1)[N+](=O)[O-])C

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Molecular Weight: 398.37
Empirical Formula: C20H18N2O7

Physical State: Dry powder
Available Amount: 152 mg

Lipinsky:
logP: 2.449
Rotatable bonds: 5
H-donors: 0
H-acceptors: 7
PSA: 126
Number of rings: 4

     

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