COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK474053
Chemical Name: 3-(1,3-benzodioxol-5-yl)-4-ethyl-5-[({2-[3-(trifluoromethyl)phenyl]-1,3-thiazol-4-yl}methyl)sulfanyl]-4H-1,2,4-triazole
Smiles: CCn1c(SCc2csc(n2)c2cccc(c2)C(F)(F)F)nnc1c1ccc2c(c1)OCO2

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Molecular Weight: 490.53
Empirical Formula: C22H17F3N4O2S2

Physical State: Dry powder
Available Amount: 130 mg

Lipinsky:
logP: 6.661
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 115
Number of rings: 5

     

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