COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL038954
Chemical Name: (E)-{2-(5-methylfuran-2-yl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(4-methylphenyl)methanolate
Smiles: Cc1ccc(cc1)/C(=C\1/C(c2ccc(o2)C)N(C(=O)C1=O)CCC[NH+]1CCOCC1)/[O-]

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Molecular Weight: 424.5
Empirical Formula: C24H28N2O5

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 3.115
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 87
Number of rings: 4

     

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