COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL231581
Chemical Name: 2-[(5Z)-5-{[5-(3,4-dimethylphenyl)furan-2-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanedioicacid
Smiles: OC(=O)CC(N1C(=S)S/C(=C\c2ccc(o2)c2ccc(c(c2)C)C)/C1=O)C(=O)O

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Molecular Weight: 431.49
Empirical Formula: C20H17NO6S2

Available Amount: 0 mg

Lipinsky:
logP: 4.363
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 165
Number of rings: 3

     

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