COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL381180
Chemical Name: {2-ethoxy-4-[(Z)-{3-[2-(4-nitrophenyl)-2-oxoethyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene}methyl]phenoxy}aceticacid
Smiles: CCOc1cc(ccc1OCC(=O)O)/C=C/1\SC(=O)N(C1=O)CC(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 486.46
Empirical Formula: C22H18N2O9S

Physical State: Dry powder
Available Amount: 345 mg

Lipinsky:
logP: 3.354
Rotatable bonds: 9
H-donors: 1
H-acceptors: 9
PSA: 181
Number of rings: 3

     

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