COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL518486
Chemical Name: 3-(2-methoxy-2-oxoethyl)-8-({[2-(4-methoxyphenyl)ethyl]ammonio}methyl)-4-methyl-2-oxo-2H-chromen-7-olate
Smiles: COC(=O)Cc1c(=O)oc2c(c1C)ccc(c2C[NH2+]CCc1ccc(cc1)OC)[O-]

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Saltdata: HCl
Molecular Weight: 411.45
Empirical Formula: C23H25NO6

Physical State: Dry powder
Available Amount: 303 mg

Lipinsky:
logP: 3.963
Rotatable bonds: 7
H-donors: 2
H-acceptors: 6
PSA: 101
Number of rings: 3

     

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