COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL038860
Chemical Name: 2,4-diiodo-6-[(E)-{[4-(2-methoxyphenyl)piperazin-4-ium-1-yl]imino}methyl]phenolate
Smiles: COc1ccccc1[NH+]1CCN(CC1)/N=C/c1cc(I)cc(c1[O-])I

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Molecular Weight: 563.18
Empirical Formula: C18H19I2N3O2

Physical State: Dry powder
Available Amount: 232 mg

Lipinsky:
logP: 5.356
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 52
Number of rings: 3

     

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