COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK698359
Chemical Name: 3-({(2E,5Z)-5-[3-chloro-5-methoxy-4-(prop-2-yn-1-yloxy)benzylidene]-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene}amino)benzoicacid
Smiles: C#CCOc1c(Cl)cc(cc1OC)/C=C/1\S/C(=N/c2cccc(c2)C(=O)O)/N(C1=O)C

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Molecular Weight: 456.91
Empirical Formula: C22H17ClN2O5S

Physical State: Dry powder
Available Amount: 509 mg

Lipinsky:
logP: 4.832
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 113
Number of rings: 3

     

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