COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL150134
Chemical Name: (E)-1-benzofuran-2-yl{1-[3-(diethylammonio)propyl]-2-(2,3-dimethoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: CC[NH+](CCCN1C(/C(=C(/c2cc3c(o2)cccc3)\[O-])/C(=O)C1=O)c1cccc(c1OC)OC)CC

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Molecular Weight: 492.57
Empirical Formula: C28H32N2O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.679
Rotatable bonds: 10
H-donors: 1
H-acceptors: 6
PSA: 96
Number of rings: 4

     

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