COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL027541
Chemical Name: (2E,4E)-5-(1,3-benzodioxol-5-yl)-1-(piperidin-1-yl)penta-2,4-dien-1-one
Smiles: O=C(N1CCCCC1)/C=C/C=C/c1ccc2c(c1)OCO2

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Molecular Weight: 285.34
Empirical Formula: C17H19NO3

Physical State: Dry powder
Available Amount: 1037 mg

Lipinsky:
logP: 2.656
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 38
Number of rings: 3

     

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