COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK142020
Chemical Name: 4-{[(2E,5E)-5-{3-bromo-5-ethoxy-4-[(4-methylbenzyl)oxy]benzylidene}-3-ethyl-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzoicacid
Smiles: CCOc1cc(/C=C\2/S/C(=N/c3ccc(cc3)C(=O)O)/N(C2=O)CC)cc(c1OCc1ccc(cc1)C)Br

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Molecular Weight: 595.51
Empirical Formula: C29H27BrN2O5S

Physical State: Dry powder
Available Amount: 70 mg

Lipinsky:
logP: 8.249
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 113
Number of rings: 4

     

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