COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL046513
Chemical Name: 4-{(E)-[(4-benzylpiperazin-4-ium-1-yl)imino]methyl}-2-bromo-6-methoxyphenolate
Smiles: COc1cc(/C=N/N2CC[NH+](CC2)Cc2ccccc2)cc(c1[O-])Br

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Molecular Weight: 404.31
Empirical Formula: C19H22BrN3O2

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: 3.554
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 52
Number of rings: 3

     

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