COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL446111
Chemical Name: 4-({(1E)-1-[2-(1,3-benzothiazol-2-yl)-3-oxo-5-(trifluoromethyl)-2,3-dihydro-1H-pyrazol-4-yl]ethylidene}amino)-N-(4-methylpyrimidin-2-yl)benzenesulfonamide
Smiles: Cc1ccnc(n1)NS(=O)(=O)c1ccc(cc1)/N=C(/c1c(=O)n([nH]c1C(F)(F)F)c1nc2c(s1)cccc2)\C

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Molecular Weight: 573.58
Empirical Formula: C24H18F3N7O3S2

Physical State: Dry powder
Available Amount: 56 mg

Lipinsky:
logP: 5.776
Rotatable bonds: 1
H-donors: 2
H-acceptors: 3
PSA: 166
Number of rings: 5

     

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