COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK377748
Chemical Name: ethyl2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-3,3,3-trifluoro-N-(pyridin-3-ylcarbonyl)alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(NC(=O)c1cccnc1)NCCc1ccc(c(c1)OC)OC

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Molecular Weight: 455.43
Empirical Formula: C21H24F3N3O5

Physical State: Dry powder
Available Amount: 204 mg

Lipinsky:
logP: 6.232
Rotatable bonds: 11
H-donors: 2
H-acceptors: 5
PSA: 98
Number of rings: 2

     

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