COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL044634
Chemical Name: (E)-1-benzofuran-2-yl{1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxo-2-(3,4,5-trimethoxyphenyl)pyrrolidin-3-ylidene}methanolate
Smiles: COc1cc(cc(c1OC)OC)C1N(CCC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1cc2c(o1)cccc2)/[O-]

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Molecular Weight: 536.58
Empirical Formula: C29H32N2O8

Physical State: Dry powder
Available Amount: 303 mg

Lipinsky:
logP: 2.925
Rotatable bonds: 7
H-donors: 1
H-acceptors: 8
PSA: 114
Number of rings: 5

     

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