COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK392719
Chemical Name: (5E)-5-[4-(2,4-dinitrophenoxy)benzylidene]-2-thioxo-3-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C/c2ccc(cc2)Oc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])/C(=O)N1c1cccc(c1)C(F)(F)F

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Molecular Weight: 547.49
Empirical Formula: C23H12F3N3O6S2

Physical State: Dry powder
Available Amount: 144 mg

Lipinsky:
logP: 6.081
Rotatable bonds: 1
H-donors: 0
H-acceptors: 6
PSA: 178
Number of rings: 4

     

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