COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK767348
Chemical Name: methyl(2E)-2-(5-tert-butyl-1,3-benzoxathiol-2-ylidene)-3,3,3-trifluoropropanoate
Smiles: COC(=O)/C(=C\1/Oc2c(S1)cc(cc2)C(C)(C)C)/C(F)(F)F

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Molecular Weight: 332.34
Empirical Formula: C15H15F3O3S

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 5.819
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 60
Number of rings: 2

     

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