COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK561694
Chemical Name: (E)-{1-[2-(diethylammonio)ethyl]-2-(5-methylfuran-2-yl)-4,5-dioxopyrrolidin-3-ylidene}(thiophen-2-yl)methanolate
Smiles: CC[NH+](CCN1C(c2ccc(o2)C)/C(=C(/c2cccs2)\[O-])/C(=O)C1=O)CC

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Molecular Weight: 388.49
Empirical Formula: C20H24N2O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.803
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 106
Number of rings: 3

     

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