COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK959928
Chemical Name: 2-amino-4-(2,5-dimethoxyphenyl)-5-oxo-1-[3-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: COc1ccc(c(c1)C1C(=C(N)N(C2=C1C(=O)CCC2)c1cccc(c1)C(F)(F)F)C#N)OC

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Molecular Weight: 469.46
Empirical Formula: C25H22F3N3O3

Available Amount: 0 mg

Lipinsky:
logP: 2.974
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 88
Number of rings: 4

     

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