COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK766061
Chemical Name: (3E)-3-[2-(4-chlorophenyl)-2-oxoethylidene]-1,2,3,6,7,11b-hexahydro-4H-pyrazino[2,1-a]isoquinolin-4-one
Smiles: Clc1ccc(cc1)C(=O)/C=C\1/NCC2N(C1=O)CCc1c2cccc1

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Molecular Weight: 352.82
Empirical Formula: C20H17ClN2O2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.889
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 49
Number of rings: 4

     

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