COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL406964
Chemical Name: 2-cyano-N-[2-(3,4-diethoxyphenyl)ethyl]-2-{3-[4-(diphenylmethyl)piperazin-1-yl]quinoxalin-2-yl}acetamide
Smiles: CCOc1cc(CCNC(=O)C(c2nc3ccccc3nc2N2CCN(CC2)C(c2ccccc2)c2ccccc2)C#N)ccc1OCC

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Molecular Weight: 654.81
Empirical Formula: C40H42N6O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.539
Rotatable bonds: 9
H-donors: 1
H-acceptors: 3
PSA: 103
Number of rings: 6

     

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