COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL299096
Chemical Name: 4-({[4-(4-ethoxyphenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile
Smiles: CCOc1ccc(cc1)n1c(SCc2ccc(cc2)C#N)nnc1c1ccc(cc1)OC

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Molecular Weight: 442.54
Empirical Formula: C25H22N4O2S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.88
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 98
Number of rings: 4

     

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