COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL015625
Chemical Name: 4-acetylphenyl2-[(2-chloro-6-nitrophenyl)sulfanyl]benzoate
Smiles: CC(=O)c1ccc(cc1)OC(=O)c1ccccc1Sc1c(Cl)cccc1[N+](=O)[O-]

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Molecular Weight: 427.86
Empirical Formula: C21H14ClNO5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.502
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 114
Number of rings: 3

     

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