COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL310290
Chemical Name: 3-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)-5-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-2-hydroxy-4H-pyran-4-one
Smiles: Fc1ccc(cc1)N1CCN(CC1)Cc1coc(c(c1=O)CN1CCc2c(C1)cccc2)O

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Molecular Weight: 449.53
Empirical Formula: C26H28FN3O3

Physical State: Dry powder
Available Amount: 304 mg

Lipinsky:
logP: 4.521
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 56
Number of rings: 5

     

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