COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL043724
Chemical Name: (E)-(4-methoxy-3-methylphenyl)[2-(2-methoxyphenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene]methanolate
Smiles: COc1ccccc1C1/C(=C(/c2ccc(c(c2)C)OC)\[O-])/C(=O)C(=O)N1Cc1ccc[nH+]c1

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Molecular Weight: 444.49
Empirical Formula: C26H24N2O5

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 3.718
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 93
Number of rings: 4

     

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