COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL149234
Chemical Name: (E)-[4-(benzyloxy)-2-methylphenyl][2-(4-ethoxy-3-methoxyphenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene]methanolate
Smiles: CCOc1ccc(cc1OC)C1N(Cc2ccc[nH+]c2)C(=O)C(=O)/C/1=C(\c1ccc(cc1C)OCc1ccccc1)/[O-]

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Molecular Weight: 564.64
Empirical Formula: C34H32N2O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.726
Rotatable bonds: 9
H-donors: 1
H-acceptors: 6
PSA: 102
Number of rings: 5

     

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