COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL046608
Chemical Name: (E)-{1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxo-2-phenylpyrrolidin-3-ylidene}(pyridin-4-yl)methanolate
Smiles: O=C1C(=O)/C(=C(\c2ccncc2)/[O-])/C(N1CCC[NH+]1CCOCC1)c1ccccc1

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Molecular Weight: 407.47
Empirical Formula: C23H25N3O4

Physical State: Dry powder
Available Amount: 252 mg

Lipinsky:
logP: 1.542
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 87
Number of rings: 4

     

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