COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL037905
Chemical Name: 4-{1-[2-(dimethylammonio)ethyl]-4-hydroxy-5-oxo-3-(phenylcarbonyl)-2,5-dihydro-1H-pyrrol-2-yl}phenolate
Smiles: C[NH+](CCN1C(c2ccc(cc2)[O-])C(=C(C1=O)O)C(=O)c1ccccc1)C

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Molecular Weight: 366.42
Empirical Formula: C21H22N2O4

Physical State: Dry powder
Available Amount: 317 mg

Lipinsky:
logP: 2.216
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 85
Number of rings: 3

     

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