COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK395508
Chemical Name: 4-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-1-methylpyridinium
Smiles: C[n+]1ccc(cc1)/C=C/c1ccc2c(c1)OCO2

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Saltdata: I-
Molecular Weight: 240.28
Empirical Formula: C15H14NO2

Physical State: Dry powder
Available Amount: 5 mg

Lipinsky:
logP: -0.855
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 22
Number of rings: 3

     

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