COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL053579
Chemical Name: 3-(3,4-dimethoxyphenyl)-8-[(4-ethylpiperazin-1-ium-1-yl)methyl]-2-methyl-4-oxo-4H-chromen-7-olate
Smiles: CCN1CC[NH+](CC1)Cc1c([O-])ccc2c1oc(C)c(c2=O)c1ccc(c(c1)OC)OC

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Molecular Weight: 438.52
Empirical Formula: C25H30N2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.668
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 75
Number of rings: 4

     

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