COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK545887
Chemical Name: prop-2-en-1-yl{3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]quinoxalin-2-yl}(cyano)acetate
Smiles: C=CCOC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)Cc1ccc2c(c1)OCO2)C#N

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Molecular Weight: 471.52
Empirical Formula: C26H25N5O4

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 3.187
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 100
Number of rings: 5

     

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