COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL111959
Chemical Name: 2-[(5E)-5-{[5-(2,3-dichlorophenyl)furan-2-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanedioicacid
Smiles: OC(=O)C(N1C(=O)/C(=C\c2ccc(o2)c2cccc(c2Cl)Cl)/SC1=S)CC(=O)O

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Molecular Weight: 472.33
Empirical Formula: C18H11Cl2NO6S2

Physical State: Dry powder
Available Amount: 13 mg

Lipinsky:
logP: 4.362
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 165
Number of rings: 3

     

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