COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK133385
Chemical Name: 2-amino-3-[2-(4-bromophenyl)-2-oxoethyl]-5-(4-ethoxyphenyl)-1-methyl-1H-imidazol-3-ium
Smiles: CCOc1ccc(cc1)c1c[n+](c(n1C)N)CC(=O)c1ccc(cc1)Br

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Saltdata: Br-
Molecular Weight: 415.31
Empirical Formula: C20H21BrN3O2

Physical State: Dry powder
Available Amount: 91 mg

Lipinsky:
logP: 0
Rotatable bonds: 3
H-donors: 2
H-acceptors: 2
PSA: 61
Number of rings: 3

     

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