COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK416971
Chemical Name: (2E)-3-(1,3-benzodioxol-5-yl)-1-(piperidin-1-yl)prop-2-en-1-one
Smiles: O=C(N1CCCCC1)/C=C/c1ccc2c(c1)OCO2

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Molecular Weight: 259.3
Empirical Formula: C15H17NO3

Physical State: Dry powder
Available Amount: 229 mg

Lipinsky:
logP: 2.861
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 38
Number of rings: 3

     

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