COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL272118
Chemical Name: 4-{[(E)-1,3-benzodioxol-5-ylmethylidene]amino}-5-(trifluoromethyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: S=c1[nH]nc(n1/N=C/c1ccc2c(c1)OCO2)C(F)(F)F

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Molecular Weight: 316.26
Empirical Formula: C11H7F3N4O2S

Physical State: Dry powder
Available Amount: 10 mg

Lipinsky:
logP: 1.847
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 90
Number of rings: 3

     

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