COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK595465
Chemical Name: 2-({5-thioxo-4-[2-(trifluoromethyl)phenyl]-4,5-dihydro-1H-1,2,4-triazol-3-yl}methyl)phthalazin-1(2H)-one
Smiles: S=c1[nH]nc(n1c1ccccc1C(F)(F)F)Cn1ncc2c(c1=O)cccc2

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Molecular Weight: 403.39
Empirical Formula: C18H12F3N5OS

Physical State: Dry powder
Available Amount: 121 mg

Lipinsky:
logP: 1.681
Rotatable bonds: 2
H-donors: 1
H-acceptors: 1
PSA: 92
Number of rings: 4

     

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