COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK545138
Chemical Name: methyl{3-[4-(3-chlorophenyl)piperazin-1-yl]quinoxalin-2-yl}(cyano)acetate
Smiles: COC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)c1cccc(c1)Cl)C#N

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Molecular Weight: 421.89
Empirical Formula: C22H20ClN5O2

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 3.415
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 82
Number of rings: 4

     

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