COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL148872
Chemical Name: (E)-{2-(4-methylphenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(phenyl)methanolate
Smiles: Cc1ccc(cc1)C1N(CCC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccccc1)/[O-]

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Molecular Weight: 420.51
Empirical Formula: C25H28N2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.494
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 74
Number of rings: 4

     

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