COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL428689
Chemical Name: [(5Z)-5-{3-methoxy-4-[(5-nitropyridin-2-yl)oxy]benzylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]aceticacid
Smiles: COc1cc(ccc1Oc1ccc(cn1)[N+](=O)[O-])/C=C/1\SC(=S)N(C1=O)CC(=O)O

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Molecular Weight: 447.45
Empirical Formula: C18H13N3O7S2

Physical State: Dry powder
Available Amount: 181 mg

Lipinsky:
logP: 0.444
Rotatable bonds: 7
H-donors: 1
H-acceptors: 7
PSA: 192
Number of rings: 3

     

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