COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK388572
Chemical Name: 2-(2,5-dimethylphenyl)-2-oxoethyl2-[(2,4-dinitrophenyl)sulfanyl]benzoate
Smiles: Cc1ccc(c(c1)C(=O)COC(=O)c1ccccc1Sc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])C

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Molecular Weight: 466.47
Empirical Formula: C23H18N2O7S

Physical State: Dry powder
Available Amount: 165 mg

Lipinsky:
logP: 6.462
Rotatable bonds: 7
H-donors: 0
H-acceptors: 7
PSA: 160
Number of rings: 3

     

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