COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK533888
Chemical Name: 2-{3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]quinoxalin-2-yl}-2-cyano-N-hexylacetamide
Smiles: CCCCCCNC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)Cc1ccc2c(c1)OCO2)C#N

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Molecular Weight: 514.63
Empirical Formula: C29H34N6O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.632
Rotatable bonds: 8
H-donors: 1
H-acceptors: 3
PSA: 103
Number of rings: 5

     

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