COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK009895
Chemical Name: 3-[2-(3,5-di-tert-butyl-4-hydroxyphenyl)-2-oxoethyl]-1-ethenyl-1H-imidazol-3-ium
Smiles: C=Cn1cc[n+](c1)CC(=O)c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C

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Saltdata: Br-
Molecular Weight: 341.47
Empirical Formula: C21H29N2O2

Physical State: Dry powder
Available Amount: 220 mg

Lipinsky:
logP: 0
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 46
Number of rings: 2

     

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