COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL369958
Chemical Name: N-(4-bromo-2,3-dimethylphenyl)-2-(2-methoxy-4-{(Z)-[3-(4-nitrobenzyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetamide
Smiles: COc1cc(ccc1OCC(=O)Nc1ccc(c(c1C)C)Br)/C=C/1\SC(=O)N(C1=O)Cc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 626.48
Empirical Formula: C28H24BrN3O7S

Physical State: Dry powder
Available Amount: 493 mg

Lipinsky:
logP: 6.511
Rotatable bonds: 6
H-donors: 1
H-acceptors: 7
PSA: 156
Number of rings: 4

     

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