COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK994727
Chemical Name: 4-[(5Z)-5-(4-methylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N'-(4-nitrophenyl)butanehydrazide
Smiles: O=C(NNc1ccc(cc1)[N+](=O)[O-])CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

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Molecular Weight: 456.55
Empirical Formula: C21H20N4O4S2

Physical State: Dry powder
Available Amount: 47 mg

Lipinsky:
logP: 3.938
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 164
Number of rings: 3

     

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