COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL045698
Chemical Name: (E)-{1-[3-(diethylammonio)propyl]-2-(4-fluorophenyl)-4,5-dioxopyrrolidin-3-ylidene}(5-methylfuran-2-yl)methanolate
Smiles: CC[NH+](CCCN1C(c2ccc(cc2)F)/C(=C(/c2ccc(o2)C)\[O-])/C(=O)C1=O)CC

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Molecular Weight: 414.48
Empirical Formula: C23H27FN2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.623
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 78
Number of rings: 3

     

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