COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL418865
Chemical Name: (2-bromo-6-methoxy-4-{(E)-[3-(4-nitrophenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)aceticacid
Smiles: COc1cc(/C=C\2/SC(=S)N(C2=O)c2ccc(cc2)[N+](=O)[O-])cc(c1OCC(=O)O)Br

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Molecular Weight: 525.36
Empirical Formula: C19H13BrN2O7S2

Physical State: Dry powder
Available Amount: 112 mg

Lipinsky:
logP: 3.974
Rotatable bonds: 6
H-donors: 1
H-acceptors: 7
PSA: 179
Number of rings: 3

     

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