COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL046343
Chemical Name: (E)-{2-(4-bromophenyl)-1-[2-(diethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(4-methoxy-3-methylphenyl)methanolate
Smiles: CC[NH+](CCN1C(=O)C(=O)/C(=C(\c2ccc(c(c2)C)OC)/[O-])/C1c1ccc(cc1)Br)CC

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Molecular Weight: 501.42
Empirical Formula: C25H29BrN2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.543
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 74
Number of rings: 3

     

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