COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL052995
Chemical Name: 3-(3-methoxyphenoxy)-8-[(4-methylpiperazin-1-ium-1-yl)methyl]-4-oxo-4H-chromen-7-olate
Smiles: COc1cccc(c1)Oc1coc2c(c1=O)ccc(c2C[NH+]1CCN(CC1)C)[O-]

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Molecular Weight: 396.44
Empirical Formula: C22H24N2O5

Physical State: Dry powder
Available Amount: 323 mg

Lipinsky:
logP: 1.963
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 75
Number of rings: 4

     

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