COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK311085
Chemical Name: 4-[1-(2,4-dichlorobenzyl)-1H-pyrazol-4-yl]-5-[1-(methylsulfonyl)piperidin-4-yl]-4H-1,2,4-triazole-3-thiol
Smiles: Clc1ccc(c(c1)Cl)Cn1ncc(c1)n1c(S)nnc1C1CCN(CC1)S(=O)(=O)C

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Molecular Weight: 487.43
Empirical Formula: C18H20Cl2N6O2S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.606
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 133
Number of rings: 4

     

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