COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL022738
Chemical Name: 2-[(5Z)-5-{[5-(3,4-dichlorophenyl)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)Cl)Cl)/C1=O)C(=O)O

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Molecular Weight: 472.33
Empirical Formula: C18H11Cl2NO6S2

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 4.453
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 165
Number of rings: 3

     

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