COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK800434
Chemical Name: N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(4-methoxybenzyl)-2-nitrobenzamide
Smiles: COc1ccc(cc1)CN(C(=O)c1ccccc1[N+](=O)[O-])C1CCS(=O)(=O)C1

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Molecular Weight: 404.44
Empirical Formula: C19H20N2O6S

Physical State: Dry powder
Available Amount: 393 mg

Lipinsky:
logP: 0.579
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 117
Number of rings: 3

     

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