COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL094761
Chemical Name: diethyl1-(1-oxo-1-{[3-(trifluoromethyl)phenyl]amino}butan-2-yl)-1H-1,2,3-triazole-4,5-dicarboxylate
Smiles: CCOC(=O)c1c(nnn1C(C(=O)Nc1cccc(c1)C(F)(F)F)CC)C(=O)OCC

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Molecular Weight: 442.39
Empirical Formula: C19H21F3N4O5

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.096
Rotatable bonds: 9
H-donors: 1
H-acceptors: 5
PSA: 112
Number of rings: 2

     

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