COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK320505
Chemical Name: methyl(2-iodo-6-methoxy-4-{(Z)-[3-(4-nitrobenzyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetate
Smiles: COC(=O)COc1c(I)cc(cc1OC)/C=C/1\SC(=O)N(C1=O)Cc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 584.35
Empirical Formula: C21H17IN2O8S

Physical State: Dry powder
Available Amount: 886 mg

Lipinsky:
logP: 3.989
Rotatable bonds: 7
H-donors: 0
H-acceptors: 8
PSA: 153
Number of rings: 3

     

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