COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL149367
Chemical Name: (E)-(7-methoxy-1-benzofuran-2-yl){2-(2-methoxyphenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: COc1ccccc1C1/C(=C(/c2oc3c(c2)cccc3OC)\[O-])/C(=O)C(=O)N1CCC[NH+]1CCOCC1

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Molecular Weight: 506.56
Empirical Formula: C28H30N2O7

Physical State: Dry powder
Available Amount: 173 mg

Lipinsky:
logP: 3.216
Rotatable bonds: 8
H-donors: 1
H-acceptors: 7
PSA: 105
Number of rings: 5

     

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