COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK566813
Chemical Name: (E)-2,3-dihydro-1,4-benzodioxin-6-yl{2-(2,3-dimethoxyphenyl)-1-[2-(dimethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: COc1c(OC)cccc1C1N(CC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/[O-]

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Molecular Weight: 468.51
Empirical Formula: C25H28N2O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.796
Rotatable bonds: 7
H-donors: 1
H-acceptors: 7
PSA: 101
Number of rings: 4

     

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