COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK562803
Chemical Name: (E)-{1-[2-(dimethylammonio)ethyl]-4,5-dioxo-2-(pyridin-4-yl)pyrrolidin-3-ylidene}(5-methyl-1-phenyl-1H-pyrazol-4-yl)methanolate
Smiles: C[NH+](CCN1C(c2ccncc2)/C(=C(/c2cnn(c2C)c2ccccc2)\[O-])/C(=O)C1=O)C

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Molecular Weight: 431.49
Empirical Formula: C24H25N5O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.168
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 95
Number of rings: 4

     

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