COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK855136
Chemical Name: (2Z)-2-(2,3-dimethoxybenzylidene)-7-[(dimethylammonio)methyl]-4-methyl-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: COc1c(cccc1OC)/C=C/1\Oc2c(C1=O)c(C)cc(c2C[NH+](C)C)[O-]

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Molecular Weight: 369.42
Empirical Formula: C21H23NO5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.077
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 72
Number of rings: 3

     

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