COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL313070
Chemical Name: 5-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)-2-hydroxy-3-{[4-(2-phenoxyethyl)piperazin-1-yl]methyl}-4H-pyran-4-one
Smiles: Oc1occ(c(=O)c1CN1CCN(CC1)CCOc1ccccc1)CN1CCc2c(C1)cccc2

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Molecular Weight: 475.59
Empirical Formula: C28H33N3O4

Physical State: Dry powder
Available Amount: 301 mg

Lipinsky:
logP: 3.87
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 65
Number of rings: 5

     

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