COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL176608
Chemical Name: 3-(difluoromethyl)-N-[(E)-{3-[(2,5-dimethylphenoxy)methyl]-4-methoxyphenyl}methylidene]-5-(methylsulfanyl)-4H-1,2,4-triazol-4-amine
Smiles: COc1ccc(cc1COc1cc(C)ccc1C)/C=N/n1c(SC)nnc1C(F)F

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Molecular Weight: 432.49
Empirical Formula: C21H22F2N4O2S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 5.886
Rotatable bonds: 8
H-donors: 0
H-acceptors: 2
PSA: 86
Number of rings: 3

     

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