COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK324941
Chemical Name: (5Z)-3-(4-methoxyphenyl)-5-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1ccc(cc1)N1C(=S)S/C(=C\c2cc3OCOc3cc2[N+](=O)[O-])/C1=O

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Molecular Weight: 416.44
Empirical Formula: C18H12N2O6S2

Physical State: Dry powder
Available Amount: 137 mg

Lipinsky:
logP: 4.452
Rotatable bonds: 1
H-donors: 0
H-acceptors: 6
PSA: 151
Number of rings: 4

     

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