COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK113183
Chemical Name: (2E,5Z)-3-cyclohexyl-5-(2-hydroxy-5-nitrobenzylidene)-2-(phenylimino)-1,3-thiazolidin-4-one
Smiles: O=C1/C(=C/c2cc(ccc2O)[N+](=O)[O-])/S/C(=N/c2ccccc2)/N1C1CCCCC1

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Molecular Weight: 423.49
Empirical Formula: C22H21N3O4S

Physical State: Dry powder
Available Amount: 174 mg

Lipinsky:
logP: 6.779
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 124
Number of rings: 4

     

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