COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK563292
Chemical Name: 2-{(E)-[(4-benzylpiperazin-4-ium-1-yl)imino]methyl}-4,6-diiodophenolate
Smiles: Ic1cc(/C=N/N2CC[NH+](CC2)Cc2ccccc2)c(c(c1)I)[O-]

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Molecular Weight: 547.18
Empirical Formula: C18H19I2N3O

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.72
Rotatable bonds: 2
H-donors: 1
H-acceptors: 1
PSA: 43
Number of rings: 3

     

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