COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK559587
Chemical Name: 2-[(E)-{[4-(4-chlorobenzyl)piperazin-4-ium-1-yl]imino}methyl]-4,6-diiodophenolate
Smiles: Clc1ccc(cc1)C[NH+]1CCN(CC1)/N=C/c1cc(I)cc(c1[O-])I

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Molecular Weight: 581.62
Empirical Formula: C18H18ClI2N3O

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.315
Rotatable bonds: 2
H-donors: 1
H-acceptors: 1
PSA: 43
Number of rings: 3

     

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