COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK561453
Chemical Name: 2-ethoxy-4-{4-hydroxy-1-[3-(morpholin-4-ium-4-yl)propyl]-5-oxo-3-(thiophen-2-ylcarbonyl)-2,5-dihydro-1H-pyrrol-2-yl}phenolate
Smiles: CCOc1cc(ccc1[O-])C1N(CCC[NH+]2CCOCC2)C(=O)C(=C1C(=O)c1cccs1)O

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Molecular Weight: 472.56
Empirical Formula: C24H28N2O6S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.786
Rotatable bonds: 10
H-donors: 2
H-acceptors: 6
PSA: 131
Number of rings: 4

     

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