COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK542969
Chemical Name: methyl2-(acetylamino)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3,3,3-trifluoroalaninate
Smiles: COC(=O)C(C(F)(F)F)(Nc1sc2c(n1)c(C)cc(c2)C)NC(=O)C

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Molecular Weight: 375.37
Empirical Formula: C15H16F3N3O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.818
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 108
Number of rings: 2

     

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