COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK822516
Chemical Name: 4-[(Z)-(3-cyclohexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl3-nitrobenzoate
Smiles: COc1cc(ccc1OC(=O)c1cccc(c1)[N+](=O)[O-])/C=C/1\SC(=S)N(C1=O)C1CCCCC1

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Molecular Weight: 498.58
Empirical Formula: C24H22N2O6S2

Physical State: Dry powder
Available Amount: 402 mg

Lipinsky:
logP: 5.198
Rotatable bonds: 6
H-donors: 0
H-acceptors: 6
PSA: 159
Number of rings: 4

     

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