COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK920535
Chemical Name: heptyl[3-(4-benzylpiperazin-1-yl)quinoxalin-2-yl](cyano)acetate
Smiles: CCCCCCCOC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)Cc1ccccc1)C#N

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Molecular Weight: 485.63
Empirical Formula: C29H35N5O2

Physical State: Dry powder
Available Amount: 341 mg

Lipinsky:
logP: 5.606
Rotatable bonds: 9
H-donors: 0
H-acceptors: 2
PSA: 82
Number of rings: 4

     

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