COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK542298
Chemical Name: methylN-(6-ethoxy-1,3-benzothiazol-2-yl)-3,3,3-trifluoro-2-(propanoylamino)alaninate
Smiles: CCOc1ccc2c(c1)sc(n2)NC(C(F)(F)F)(C(=O)OC)NC(=O)CC

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Molecular Weight: 405.4
Empirical Formula: C16H18F3N3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.876
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 117
Number of rings: 2

     

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