COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL148338
Chemical Name: (E)-[4-(benzyloxy)-2-methylphenyl]{1-[2-(morpholin-4-ium-4-yl)ethyl]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: O=C1C(=O)/C(=C(\c2ccc(cc2C)OCc2ccccc2)/[O-])/C(N1CC[NH+]1CCOCC1)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 557.6
Empirical Formula: C31H31N3O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.7
Rotatable bonds: 7
H-donors: 1
H-acceptors: 7
PSA: 129
Number of rings: 5

     

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