COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK560529
Chemical Name: (E)-{1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxo-2-[4-(propan-2-yl)phenyl]pyrrolidin-3-ylidene}(phenyl)methanolate
Smiles: CC(c1ccc(cc1)C1/C(=C(/c2ccccc2)\[O-])/C(=O)C(=O)N1CC[NH+]1CCOCC1)C

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Molecular Weight: 434.54
Empirical Formula: C26H30N2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.248
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 74
Number of rings: 4

     

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