COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL551597
Chemical Name: methyl3-(2,4-dimethoxyphenyl)-3-{6-[(4-formylpiperazin-1-yl)methyl]-3-hydroxy-4-oxo-4H-pyran-2-yl}propanoate
Smiles: COC(=O)CC(c1ccc(cc1OC)OC)c1oc(CN2CCN(CC2)C=O)cc(=O)c1O

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Molecular Weight: 460.48
Empirical Formula: C23H28N2O8

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.332
Rotatable bonds: 9
H-donors: 1
H-acceptors: 8
PSA: 114
Number of rings: 3

     

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