COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK977127
Chemical Name: 2-(1,3-benzothiazol-2-yl)-4-[(1Z)-N-(2-phenylethyl)propanimidoyl]-5-(trifluoromethyl)-1,2-dihydro-3H-pyrazol-3-one
Smiles: CC/C(=N/CCc1ccccc1)/c1c(=O)n([nH]c1C(F)(F)F)c1nc2c(s1)cccc2

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Molecular Weight: 444.48
Empirical Formula: C22H19F3N4OS

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 7.202
Rotatable bonds: 4
H-donors: 1
H-acceptors: 1
PSA: 85
Number of rings: 4

     

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