COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL173809
Chemical Name: 5-(difluoromethyl)-4-{[(E)-(4-methoxy-3-{[3-(trifluoromethyl)phenoxy]methyl}phenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1COc1cccc(c1)C(F)(F)F)/C=N/n1c(S)nnc1C(F)F

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Molecular Weight: 458.41
Empirical Formula: C19H15F5N4O2S

Physical State: Dry powder
Available Amount: 54 mg

Lipinsky:
logP: 5.904
Rotatable bonds: 8
H-donors: 0
H-acceptors: 2
PSA: 100
Number of rings: 3

     

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