COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK090084
Chemical Name: (3E,5E)-3,5-bis(4-ethoxybenzylidene)-1-(propan-2-yl)piperidin-4-one
Smiles: CCOc1ccc(cc1)/C=C/1\CN(C/C(=C\c2ccc(cc2)OCC)/C1=O)C(C)C

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Molecular Weight: 405.54
Empirical Formula: C26H31NO3

Physical State: Dry powder
Available Amount: 180 mg

Lipinsky:
logP: 7.232
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 38
Number of rings: 3

     

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