COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK559354
Chemical Name: [2-({(E)-[1-(1,3-benzothiazol-2-yl)-5-hydroxy-3-(trifluoromethyl)-1H-pyrazol-4-yl]methylidene}amino)-5-chlorophenyl](phenyl)methanone
Smiles: Clc1ccc(c(c1)C(=O)c1ccccc1)/N=C/c1c(O)n(nc1C(F)(F)F)c1nc2c(s1)cccc2

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Molecular Weight: 526.93
Empirical Formula: C25H14ClF3N4O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.928
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 108
Number of rings: 5

     

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