COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL050016
Chemical Name: methylN-[(2,4-dichlorophenyl)carbonyl]-3,3,3-trifluoro-2-{[4-(1,1,1-trifluoro-2-hydroxy-3-methoxy-3-oxopropan-2-yl)phenyl]amino}alaninate
Smiles: COC(=O)C(C(F)(F)F)(NC(=O)c1ccc(cc1Cl)Cl)Nc1ccc(cc1)C(C(F)(F)F)(C(=O)OC)O

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Molecular Weight: 577.26
Empirical Formula: C21H16Cl2F6N2O6

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 7.181
Rotatable bonds: 8
H-donors: 3
H-acceptors: 6
PSA: 113
Number of rings: 2

     

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