COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK565530
Chemical Name: (E)-{2-(3-bromophenyl)-1-[3-(dimethylammonio)propyl]-4,5-dioxopyrrolidin-3-ylidene}(phenyl)methanolate
Smiles: Brc1cccc(c1)C1/C(=C(/c2ccccc2)\[O-])/C(=O)C(=O)N1CCC[NH+](C)C

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Molecular Weight: 443.34
Empirical Formula: C22H23BrN2O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.199
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 64
Number of rings: 3

     

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