COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL173341
Chemical Name: N-[(E)-{5-[(2-chloro-6-methylphenoxy)methyl]furan-2-yl}methylidene]-3-(ethylsulfanyl)-5-(trifluoromethyl)-4H-1,2,4-triazol-4-amine
Smiles: CCSc1nnc(n1/N=C/c1ccc(o1)COc1c(C)cccc1Cl)C(F)(F)F

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Molecular Weight: 444.86
Empirical Formula: C18H16ClF3N4O2S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 5.678
Rotatable bonds: 7
H-donors: 0
H-acceptors: 2
PSA: 90
Number of rings: 3

     

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