COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK112974
Chemical Name: (2Z,6Z)-2-(3-hydroxybenzylidene)-6-(2,2,2-trifluoro-1-hydroxyethylidene)cyclohexanone
Smiles: Oc1cccc(c1)/C=C\1/CCC/C(=C(\C(F)(F)F)/O)/C1=O

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Molecular Weight: 298.26
Empirical Formula: C15H13F3O3

Physical State: Dry powder
Available Amount: 454 mg

Lipinsky:
logP: 5.475
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 57
Number of rings: 2

     

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