COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK767335
Chemical Name: 4-{[2-chloro-1,1,2-trifluoro-2-(trifluoromethoxy)ethyl]sulfanyl}-5-methyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: FC(C(OC(F)(F)F)(Cl)F)(Sc1c(C)[nH]n(c1=O)c1ccccc1)F

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Molecular Weight: 406.74
Empirical Formula: C13H9ClF6N2O2S

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 9.36
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 66
Number of rings: 2

     

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