COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK810829
Chemical Name: (5E)-3-(butan-2-yl)-5-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCC(N1C(=S)S/C(=C/c2ccc(o2)c2cccc(c2)[N+](=O)[O-])/C1=O)C

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Molecular Weight: 388.47
Empirical Formula: C18H16N2O4S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.218
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 136
Number of rings: 3

     

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