COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK699930
Chemical Name: 1-(5,5-dimethyl-3-{[(E)-(4-methylphenyl)methylidene]amino}-2-thioxo-1,3-thiazolidin-4-yl)-1-hydroxy-3-(4-nitrophenyl)urea
Smiles: Cc1ccc(cc1)/C=N/N1C(=S)SC(C1N(C(=O)Nc1ccc(cc1)[N+](=O)[O-])O)(C)C

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Molecular Weight: 459.55
Empirical Formula: C20H21N5O4S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.261
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 171
Number of rings: 3

     

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