COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL037680
Chemical Name: (E)-[4-(benzyloxy)-2-methylphenyl]{2-(4-ethylphenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: CCc1ccc(cc1)C1N(CC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccc(cc1C)OCc1ccccc1)/[O-]

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Molecular Weight: 540.66
Empirical Formula: C33H36N2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.962
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 83
Number of rings: 5

     

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