COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK562012
Chemical Name: (E)-(5-methylfuran-2-yl){1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxo-2-(3,4,5-trimethoxyphenyl)pyrrolidin-3-ylidene}methanolate
Smiles: COc1c(OC)cc(cc1OC)C1/C(=C(/c2ccc(o2)C)\[O-])/C(=O)C(=O)N1CC[NH+]1CCOCC1

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Molecular Weight: 486.52
Empirical Formula: C25H30N2O8

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.43
Rotatable bonds: 6
H-donors: 1
H-acceptors: 8
PSA: 114
Number of rings: 4

     

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