COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK605912
Chemical Name: 2-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)-3-hydroxy-6-(hydroxymethyl)-4H-pyran-4-one
Smiles: OCc1cc(=O)c(c(o1)CN1CCc2c(C1)cccc2)O

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Molecular Weight: 287.32
Empirical Formula: C16H17NO4

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 2.444
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 70
Number of rings: 3

     

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