COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL254668
Chemical Name: 4-(methylsulfonyl)-2-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoicacid
Smiles: OC(=O)C(N1C(=O)c2c(C1=O)cccc2[N+](=O)[O-])CCS(=O)(=O)C

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Molecular Weight: 356.31
Empirical Formula: C13H12N2O8S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.678
Rotatable bonds: 6
H-donors: 1
H-acceptors: 8
PSA: 163
Number of rings: 2

     

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