COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL034491
Chemical Name: methyl4-{[(4-methylphenyl)sulfonyl]methyl}-5-nitro-2-(prop-2-en-1-yloxy)benzoate
Smiles: C=CCOc1cc(CS(=O)(=O)c2ccc(cc2)C)c(cc1C(=O)OC)[N+](=O)[O-]

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Molecular Weight: 405.43
Empirical Formula: C19H19NO7S

Available Amount: 0 mg

Lipinsky:
logP: 3.229
Rotatable bonds: 7
H-donors: 0
H-acceptors: 7
PSA: 123
Number of rings: 2

     

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