COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK562589
Chemical Name: (E)-(4-bromophenyl){2-(4-ethoxyphenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: CCOc1ccc(cc1)C1/C(=C(/c2ccc(cc2)Br)\[O-])/C(=O)C(=O)N1CC[NH+]1CCOCC1

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Molecular Weight: 515.4
Empirical Formula: C25H27BrN2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.247
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 83
Number of rings: 4

     

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