COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL024766
Chemical Name: 8-ethyl6-methyl(2Z)-5-amino-2-(3-nitrobenzylidene)-7-(3-nitrophenyl)-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate
Smiles: CCOC(=O)C1=c2s/c(=C\c3cccc(c3)[N+](=O)[O-])/c(=O)n2C(=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)OC)N

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Molecular Weight: 552.52
Empirical Formula: C25H20N4O9S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.815
Rotatable bonds: 7
H-donors: 2
H-acceptors: 9
PSA: 215
Number of rings: 4

     

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