COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL094673
Chemical Name: 5-amino-N-(1,3-benzodioxol-5-ylmethyl)-1-{2-[(2-ethoxyphenyl)amino]-2-oxoethyl}-1H-1,2,3-triazole-4-carboxamide
Smiles: CCOc1ccccc1NC(=O)Cn1nnc(c1N)C(=O)NCc1ccc2c(c1)OCO2

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Molecular Weight: 438.44
Empirical Formula: C21H22N6O5

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 1.395
Rotatable bonds: 7
H-donors: 4
H-acceptors: 5
PSA: 142
Number of rings: 4

     

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