COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL045331
Chemical Name: (E)-{2-(5-methylfuran-2-yl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(4-methylphenyl)methanolate
Smiles: Cc1ccc(o1)C1/C(=C(/c2ccc(cc2)C)\[O-])/C(=O)C(=O)N1CC[NH+]1CCOCC1

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Molecular Weight: 410.47
Empirical Formula: C23H26N2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.991
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 87
Number of rings: 4

     

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