COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL173454
Chemical Name: N-[(E)-{3-[(2,5-dimethylphenoxy)methyl]-4-methoxyphenyl}methylidene]-3-(methylsulfanyl)-4H-1,2,4-triazol-4-amine
Smiles: COc1ccc(cc1COc1cc(C)ccc1C)/C=N/n1cnnc1SC

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Molecular Weight: 382.49
Empirical Formula: C20H22N4O2S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 5.127
Rotatable bonds: 7
H-donors: 0
H-acceptors: 2
PSA: 86
Number of rings: 3

     

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