COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK714392
Chemical Name: 2-{3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]quinoxalin-2-yl}-2-cyano-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
Smiles: N#CC(c1nc2ccccc2nc1N1CCN(CC1)Cc1ccc2c(c1)OCO2)C(=O)NCCc1ccc(c(c1)OC)OC

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Molecular Weight: 594.67
Empirical Formula: C33H34N6O5

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 2.885
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 122
Number of rings: 6

     

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