COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK766436
Chemical Name: (3E)-3-[2-(3,4-dimethoxyphenyl)-2-oxoethylidene]-1,2,3,6,7,11b-hexahydro-4H-pyrazino[2,1-a]isoquinolin-4-one
Smiles: COc1cc(ccc1OC)C(=O)/C=C\1/NCC2N(C1=O)CCc1c2cccc1

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Molecular Weight: 378.43
Empirical Formula: C22H22N2O4

Available Amount: 0 mg

Lipinsky:
logP: 2.363
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 67
Number of rings: 4

     

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