COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK994721
Chemical Name: N'-{4-[(5E)-5-(4-methylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}-4-nitrobenzohydrazide
Smiles: O=C(NNC(=O)c1ccc(cc1)[N+](=O)[O-])CCCN1C(=S)S/C(=C/c2ccc(cc2)C)/C1=O

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Molecular Weight: 484.56
Empirical Formula: C22H20N4O5S2

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 3.074
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 181
Number of rings: 3

     

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