COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK714375
Chemical Name: 2-methylpropyl{3-[4-(3-chlorophenyl)piperazin-1-yl]quinoxalin-2-yl}(cyano)acetate
Smiles: N#CC(c1nc2ccccc2nc1N1CCN(CC1)c1cccc(c1)Cl)C(=O)OCC(C)C

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Molecular Weight: 463.97
Empirical Formula: C25H26ClN5O2

Physical State: Dry powder
Available Amount: 388 mg

Lipinsky:
logP: 4.825
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 82
Number of rings: 4

     

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