COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK019577
Chemical Name: ethyl2,7,7-trimethyl-5-oxo-4-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCOC(=O)C1=C(C)NC2=C(C1c1ccccc1C(F)(F)F)C(=O)CC(C2)(C)C

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Molecular Weight: 407.43
Empirical Formula: C22H24F3NO3

Physical State: Dry powder
Available Amount: 346 mg

Lipinsky:
logP: 3.779
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 55
Number of rings: 3

     

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