COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL453977
Chemical Name: 5-{[(E)-1,3-benzodioxol-5-ylmethylidene]amino}-4-benzyl-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1Cc1ccccc1)/N=C/c1ccc2c(c1)OCO2

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Molecular Weight: 338.39
Empirical Formula: C17H14N4O2S

Available Amount: 0 mg

Lipinsky:
logP: 3.828
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 100
Number of rings: 4

     

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