COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL046145
Chemical Name: 1-(1,3-benzothiazol-2-yl)-4-[(1E)-N-(5-chloro-2-hydroxyphenyl)ethanimidoyl]-3-(trifluoromethyl)-1H-pyrazol-5-ol
Smiles: Clc1ccc(c(c1)/N=C(/c1c(O)n(nc1C(F)(F)F)c1nc2c(s1)cccc2)\C)O

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Molecular Weight: 452.84
Empirical Formula: C19H12ClF3N4O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.089
Rotatable bonds: 3
H-donors: 2
H-acceptors: 2
PSA: 111
Number of rings: 4

     

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