COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL044103
Chemical Name: (E)-{1-[3-(diethylammonio)propyl]-2-(5-methylfuran-2-yl)-4,5-dioxopyrrolidin-3-ylidene}(7-methoxy-1-benzofuran-2-yl)methanolate
Smiles: COc1cccc2c1oc(c2)/C(=C/1\C(=O)C(=O)N(C1c1ccc(o1)C)CCC[NH+](CC)CC)/[O-]

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Molecular Weight: 466.53
Empirical Formula: C26H30N2O6

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.379
Rotatable bonds: 9
H-donors: 1
H-acceptors: 6
PSA: 100
Number of rings: 4

     

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