COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK842279
Chemical Name: 2-({[4-chloro-2-(trifluoromethyl)phenyl]amino}methylidene)-5,5-dimethylcyclohexane-1,3-dione
Smiles: Clc1ccc(c(c1)C(F)(F)F)NC=C1C(=O)CC(CC1=O)(C)C

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Molecular Weight: 345.75
Empirical Formula: C16H15ClF3NO2

Physical State: Dry powder
Available Amount: 359 mg

Lipinsky:
logP: 3.988
Rotatable bonds: 0
H-donors: 1
H-acceptors: 2
PSA: 46
Number of rings: 2

     

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