COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL022739
Chemical Name: 2-[(5E)-5-{[5-(2-bromo-4-methylphenyl)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(cc2Br)C)/C1=O)C(=O)O

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Molecular Weight: 496.36
Empirical Formula: C19H14BrNO6S2

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 4.472
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 165
Number of rings: 3

     

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