COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL037430
Chemical Name: (E)-[4-(benzyloxy)-3-methylphenyl]{1-[2-(diethylammonio)ethyl]-2-(3,4-dimethoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: COc1cc(ccc1OC)C1N(CC[NH+](CC)CC)C(=O)C(=O)/C/1=C(\c1ccc(c(c1)C)OCc1ccccc1)/[O-]

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Molecular Weight: 558.67
Empirical Formula: C33H38N2O6

Physical State: Dry powder
Available Amount: 303 mg

Lipinsky:
logP: 6.164
Rotatable bonds: 11
H-donors: 1
H-acceptors: 6
PSA: 92
Number of rings: 4

     

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