COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK108933
Chemical Name: methyl4-({[3-(4-tert-butylphenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl)benzoate
Smiles: COC(=O)c1ccc(cc1)/C=N/n1c(S)nnc1c1ccc(cc1)C(C)(C)C

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Molecular Weight: 394.5
Empirical Formula: C21H22N4O2S

Physical State: Dry powder
Available Amount: 82 mg

Lipinsky:
logP: 6.927
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 108
Number of rings: 3

     

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