COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL321965
Chemical Name: 2-{(2Z)-3-[(3-methoxyphenyl)amino]prop-2-enoyl}-5,5-dimethylcyclohexane-1,3-dione
Smiles: COc1cccc(c1)N/C=C\C(=O)C1C(=O)CC(CC1=O)(C)C

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Molecular Weight: 315.37
Empirical Formula: C18H21NO4

Available Amount: 0 mg

Lipinsky:
logP: 1.847
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 72
Number of rings: 2

     

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