COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL323133
Chemical Name: 2-[2-(chloroacetyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]cyclohexane-1,3-dione
Smiles: ClCC(=O)N1CCc2c(C1C1C(=O)CCCC1=O)cccc2

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Molecular Weight: 319.79
Empirical Formula: C17H18ClNO3

Physical State: Dry powder
Available Amount: 13 mg

Lipinsky:
logP: 1.481
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 54
Number of rings: 3

     

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