COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK705964
Chemical Name: N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(4-ethylbenzyl)-4-nitrobenzamide
Smiles: CCc1ccc(cc1)CN(C(=O)c1ccc(cc1)[N+](=O)[O-])C1CCS(=O)(=O)C1

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Molecular Weight: 402.47
Empirical Formula: C20H22N2O5S

Physical State: Dry powder
Available Amount: 395 mg

Lipinsky:
logP: 2.119
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 108
Number of rings: 3

     

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