COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK290684
Chemical Name: 4-nitrobenzyl1-(6-ethoxy-1,3-benzothiazol-2-yl)-5-oxopyrrolidine-3-carboxylate
Smiles: CCOc1ccc2c(c1)sc(n2)N1CC(CC1=O)C(=O)OCc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 441.46
Empirical Formula: C21H19N3O6S

Physical State: Dry powder
Available Amount: 104 mg

Lipinsky:
logP: 3.037
Rotatable bonds: 5
H-donors: 0
H-acceptors: 6
PSA: 142
Number of rings: 4

     

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