COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL043189
Chemical Name: 1-[(4-acetyl-2,2-dimethyl-5-oxo-2,5-dihydrofuran-3-yl)methyl]pyridinium
Smiles: CC(=O)C1=C(C[n+]2ccccc2)C(OC1=O)(C)C

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Saltdata: I-
Molecular Weight: 246.29
Empirical Formula: C14H16NO3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -4.433
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 47
Number of rings: 2

     

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