COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK445823
Chemical Name: 5-{[(2-chloro-4-fluorobenzyl)sulfanyl]methyl}-4-(2,5-dimethoxyphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1n1c(CSCc2ccc(cc2Cl)F)nnc1S)OC

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Molecular Weight: 425.94
Empirical Formula: C18H17ClFN3O2S2

Physical State: Dry powder
Available Amount: 157 mg

Lipinsky:
logP: 5.316
Rotatable bonds: 7
H-donors: 0
H-acceptors: 2
PSA: 113
Number of rings: 3

     

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