COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK363566
Chemical Name: 4-(2,5-dimethoxyphenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: COc1ccc(c(c1)C1C2=C(CC(CC2=O)c2ccccc2)NC(=C1C#N)C)OC

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Molecular Weight: 400.48
Empirical Formula: C25H24N2O3

Physical State: Dry powder
Available Amount: 149 mg

Lipinsky:
logP: 3.334
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 71
Number of rings: 4

     

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