COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL514130
Chemical Name: 2-(ethoxycarbonyl)-3-(2-methoxyphenyl)-8-[(4-methylpiperazin-1-ium-1-yl)methyl]-4-oxo-4H-chromen-7-olate
Smiles: CCOC(=O)c1oc2c(C[NH+]3CCN(CC3)C)c([O-])ccc2c(=O)c1c1ccccc1OC

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Molecular Weight: 452.51
Empirical Formula: C25H28N2O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.8
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 92
Number of rings: 4

     

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