COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL315206
Chemical Name: 5-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)-3-({4-[2-(4-fluorophenoxy)ethyl]piperazin-1-yl}methyl)-2-hydroxy-4H-pyran-4-one
Smiles: Fc1ccc(cc1)OCCN1CCN(CC1)Cc1c(O)occ(c1=O)CN1CCc2c(C1)cccc2

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Molecular Weight: 493.58
Empirical Formula: C28H32FN3O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.996
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 65
Number of rings: 5

     

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