COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK029556
Chemical Name: (2E)-3-(1,3-benzodioxol-5-yl)prop-2-enal
Smiles: O=C/C=C/c1ccc2c(c1)OCO2

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Molecular Weight: 176.17
Empirical Formula: C10H8O3

Physical State: Dry powder
Available Amount: 286 mg

Lipinsky:
logP: 2.245
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 35
Number of rings: 2

     

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