COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK509351
Chemical Name: (4Z)-4-[4-(benzyloxy)-3-bromo-5-ethoxybenzylidene]-2-(ethylsulfanyl)-1,3-thiazol-5(4H)-one
Smiles: CCSC1=N/C(=C\c2cc(Br)c(c(c2)OCC)OCc2ccccc2)/C(=O)S1

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Molecular Weight: 478.43
Empirical Formula: C21H20BrNO3S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 6.808
Rotatable bonds: 7
H-donors: 0
H-acceptors: 3
PSA: 98
Number of rings: 3

     

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