COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK598951
Chemical Name: (3Z,11aS)-3-[4-(benzyloxy)benzylidene]-11,11a-dihydro-2H-pyrazino[1,2-b]isoquinoline-1,4(3H,6H)-dione
Smiles: O=C1N/C(=C\c2ccc(cc2)OCc2ccccc2)/C(=O)N2[C@H]1Cc1ccccc1C2

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Molecular Weight: 410.47
Empirical Formula: C26H22N2O3

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 4.485
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 58
Number of rings: 5

     

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