COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK701871
Chemical Name: (5Z)-3-(2-ethylhexyl)-5-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCCCC(CN1C(=S)S/C(=C\c2ccc(o2)c2cccc(c2)[N+](=O)[O-])/C1=O)CC

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Molecular Weight: 444.58
Empirical Formula: C22H24N2O4S2

Physical State: Dry powder
Available Amount: 384 mg

Lipinsky:
logP: 6.343
Rotatable bonds: 8
H-donors: 0
H-acceptors: 4
PSA: 136
Number of rings: 3

     

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