COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK036270
Chemical Name: 2-methylpropyl2-methyl-5-oxo-4-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CC(COC(=O)C1=C(C)NC2=C(C1c1ccccc1C(F)(F)F)C(=O)CCC2)C

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Molecular Weight: 407.43
Empirical Formula: C22H24F3NO3

Physical State: Dry powder
Available Amount: 172 mg

Lipinsky:
logP: 3.625
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 55
Number of rings: 3

     

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