COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK278246
Chemical Name: 2-[4-chloro-3-(trifluoromethyl)phenyl]-5,6-dimethyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Smiles: O=C1N(c2ccc(c(c2)C(F)(F)F)Cl)C(=O)C2C1CC(=C(C2)C)C

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Molecular Weight: 357.76
Empirical Formula: C17H15ClF3NO2

Physical State: Dry powder
Available Amount: 153 mg

Lipinsky:
logP: 4.369
Rotatable bonds: 0
H-donors: 0
H-acceptors: 2
PSA: 37
Number of rings: 3

     

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