COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL149913
Chemical Name: (E)-(3-chloro-4-ethoxyphenyl){1-[3-(diethylammonio)propyl]-2-(4-ethoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: CCOc1ccc(cc1)C1/C(=C(/c2ccc(c(c2)Cl)OCC)\[O-])/C(=O)C(=O)N1CCC[NH+](CC)CC

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Molecular Weight: 515.05
Empirical Formula: C28H35ClN2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.969
Rotatable bonds: 10
H-donors: 1
H-acceptors: 5
PSA: 83
Number of rings: 3

     

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