COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK035001
Chemical Name: 5,5-dimethyl-2-[({[1-(phenylacetyl)piperidin-4-yl]methyl}amino)methylidene]cyclohexane-1,3-dione
Smiles: O=C(N1CCC(CC1)CNC=C1C(=O)CC(CC1=O)(C)C)Cc1ccccc1

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Molecular Weight: 382.5
Empirical Formula: C23H30N2O3

Physical State: Dry powder
Available Amount: 62 mg

Lipinsky:
logP: 2.251
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 66
Number of rings: 3

     

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