COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL044036
Chemical Name: (E)-[4-(benzyloxy)-3-methylphenyl]{1-[2-(diethylammonio)ethyl]-2-(4-ethylphenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: CC[NH+](CCN1C(=O)C(=O)/C(=C(\c2ccc(c(c2)C)OCc2ccccc2)/[O-])/C1c1ccc(cc1)CC)CC

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Molecular Weight: 526.68
Empirical Formula: C33H38N2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.418
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 74
Number of rings: 4

     

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