COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL330734
Chemical Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[3-(4-benzylpiperazin-1-yl)quinoxalin-2-yl]-2-cyanoacetamide
Smiles: N#CC(c1nc2ccccc2nc1N1CCN(CC1)Cc1ccccc1)C(=O)NCc1ccc2c(c1)OCO2

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Molecular Weight: 520.59
Empirical Formula: C30H28N6O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.788
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 103
Number of rings: 6

     

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