COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK698347
Chemical Name: 3-({(2E,5Z)-5-[3,5-dichloro-4-(prop-2-yn-1-yloxy)benzylidene]-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene}amino)benzoicacid
Smiles: C#CCOc1c(Cl)cc(cc1Cl)/C=C/1\S/C(=N/c2cccc(c2)C(=O)O)/N(C1=O)C

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Molecular Weight: 461.32
Empirical Formula: C21H14Cl2N2O4S

Physical State: Dry powder
Available Amount: 189 mg

Lipinsky:
logP: 5.286
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 104
Number of rings: 3

     

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