COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK564835
Chemical Name: (E)-1-benzofuran-2-yl{1-[2-(dimethylammonio)ethyl]-4,5-dioxo-2-(3,4,5-trimethoxyphenyl)pyrrolidin-3-ylidene}methanolate
Smiles: COc1cc(cc(c1OC)OC)C1N(CC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1cc2c(o1)cccc2)/[O-]

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Molecular Weight: 480.52
Empirical Formula: C26H28N2O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.194
Rotatable bonds: 6
H-donors: 1
H-acceptors: 7
PSA: 105
Number of rings: 4

     

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