COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL549801
Chemical Name: methyl3-{6-[(4-formylpiperazin-1-yl)methyl]-3-hydroxy-4-oxo-4H-pyran-2-yl}-3-(4-hydroxyphenyl)propanoate
Smiles: COC(=O)CC(c1oc(CN2CCN(CC2)C=O)cc(=O)c1O)c1ccc(cc1)O

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Molecular Weight: 416.43
Empirical Formula: C21H24N2O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.885
Rotatable bonds: 7
H-donors: 2
H-acceptors: 7
PSA: 116
Number of rings: 3

     

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