COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL047651
Chemical Name: (E)-{1-[2-(diethylammonio)ethyl]-2-(4-methylphenyl)-4,5-dioxopyrrolidin-3-ylidene}(4-methoxy-2-methylphenyl)methanolate
Smiles: CC[NH+](CCN1C(=O)C(=O)/C(=C(\c2ccc(cc2C)OC)/[O-])/C1c1ccc(cc1)C)CC

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Molecular Weight: 436.55
Empirical Formula: C26H32N2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.232
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 74
Number of rings: 3

     

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