COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK693246
Chemical Name: (3Z,5E)-3,5-bis[(4,7-dimethoxy-1,3-benzodioxol-5-yl)methylidene]-1-methylpiperidin-4-one
Smiles: COc1c(/C=C/2\CN(C)C/C(=C/c3cc(OC)c4c(c3OC)OCO4)/C2=O)cc(c2c1OCO2)OC

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Molecular Weight: 497.5
Empirical Formula: C26H27NO9

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.709
Rotatable bonds: 6
H-donors: 0
H-acceptors: 9
PSA: 94
Number of rings: 5

     

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