COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL325884
Chemical Name: ethyl2-[(1,3-benzodioxol-5-ylmethyl)amino]-3,3,3-trifluoro-N-(phenylcarbonyl)alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(NC(=O)c1ccccc1)NCc1ccc2c(c1)OCO2

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Molecular Weight: 424.38
Empirical Formula: C20H19F3N2O5

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 7.453
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 85
Number of rings: 3

     

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