COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL052444
Chemical Name: (E)-[2-(4-ethoxyphenyl)-4,5-dioxo-1-(pyridinium-4-ylmethyl)pyrrolidin-3-ylidene]{4-[(3-methylbenzyl)oxy]phenyl}methanolate
Smiles: CCOc1ccc(cc1)C1N(Cc2cc[nH+]cc2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OCc1cccc(c1)C)/[O-]

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Molecular Weight: 534.61
Empirical Formula: C33H30N2O5

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.904
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 93
Number of rings: 5

     

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