COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL094779
Chemical Name: diethyl1-{1-[(2-methoxy-5-methylphenyl)amino]-1-oxobutan-2-yl}-1H-1,2,3-triazole-4,5-dicarboxylate
Smiles: CCOC(=O)c1c(nnn1C(C(=O)Nc1cc(C)ccc1OC)CC)C(=O)OCC

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Molecular Weight: 418.45
Empirical Formula: C20H26N4O6

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 2.336
Rotatable bonds: 10
H-donors: 1
H-acceptors: 6
PSA: 121
Number of rings: 2

     

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