COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL177376
Chemical Name: N-[(E)-{4-[(3,4-diethoxybenzyl)oxy]phenyl}methylidene]-3-(difluoromethyl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-amine
Smiles: CCOc1cc(COc2ccc(cc2)/C=N/n2c(SC)nnc2C(F)F)ccc1OCC

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Molecular Weight: 462.52
Empirical Formula: C22H24F2N4O3S

Physical State: Dry powder
Available Amount: 24 mg

Lipinsky:
logP: 5.85
Rotatable bonds: 9
H-donors: 0
H-acceptors: 3
PSA: 96
Number of rings: 3

     

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