COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL272953
Chemical Name: 2-[3-(1H-benzotriazol-1-ylmethyl)-4-(4-ethoxyphenyl)-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-N-(4-methylphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(nn(c1=S)CC(=O)Nc1ccc(cc1)C)Cn1nnc2c1cccc2

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Molecular Weight: 499.6
Empirical Formula: C26H25N7O2S

Available Amount: 0 mg

Lipinsky:
logP: 4.255
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 119
Number of rings: 5

     

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