COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK000599
Chemical Name: 3,3'-(benzene-1,2-diyldiimino)bis(5,5-dimethylcyclohex-2-en-1-one)
Smiles: O=C1C=C(CC(C1)(C)C)Nc1ccccc1NC1=CC(=O)CC(C1)(C)C

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Molecular Weight: 352.48
Empirical Formula: C22H28N2O2

Physical State: Dry powder
Available Amount: 328 mg

Lipinsky:
logP: 3.298
Rotatable bonds: 0
H-donors: 2
H-acceptors: 2
PSA: 58
Number of rings: 3

     

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