COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK072208
Chemical Name: 4-[(4-methylphenyl)sulfonyl]but-2-yn-1-yl4-nitrobenzoate
Smiles: Cc1ccc(cc1)S(=O)(=O)CC#CCOC(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 373.39
Empirical Formula: C18H15NO6S

Physical State: Dry powder
Available Amount: 15 mg

Lipinsky:
logP: 3.555
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 114
Number of rings: 2

     

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