COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL380903
Chemical Name: (5Z)-5-{4-[(2-hydroxyethyl)sulfanyl]-3-nitrobenzylidene}-3-[2-oxo-2-(piperidin-1-yl)ethyl]-1,3-thiazolidine-2,4-dione
Smiles: OCCSc1ccc(cc1[N+](=O)[O-])/C=C/1\SC(=O)N(C1=O)CC(=O)N1CCCCC1

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Molecular Weight: 451.52
Empirical Formula: C19H21N3O6S2

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 3.081
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 174
Number of rings: 3

     

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