COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK759268
Chemical Name: (2E,5E)-3-cyclohexyl-5-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-2-(phenylimino)-1,3-thiazolidin-4-one
Smiles: O=C1/C(=C\c2cc3OCOc3cc2[N+](=O)[O-])/S/C(=N/c2ccccc2)/N1C1CCCCC1

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Molecular Weight: 451.5
Empirical Formula: C23H21N3O5S

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 6.583
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 122
Number of rings: 5

     

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