COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL002497
Chemical Name: 4-[(E)-{[3-(4-tert-butylphenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl]-2-methoxyphenol
Smiles: COc1cc(/C=N/n2c(S)nnc2c2ccc(cc2)C(C)(C)C)ccc1O

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Molecular Weight: 382.49
Empirical Formula: C20H22N4O2S

Available Amount: 0 mg

Lipinsky:
logP: 6.148
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 111
Number of rings: 3

     

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