COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK145169
Chemical Name: 1-(3-nitrobenzyl)-4-(3,4,5-trimethoxybenzyl)piperazine
Smiles: COc1cc(CN2CCN(CC2)Cc2cccc(c2)[N+](=O)[O-])cc(c1OC)OC

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Saltdata: C2H2O4
Molecular Weight: 401.46
Empirical Formula: C21H27N3O5

Physical State: Dry powder
Available Amount: 144 mg

Lipinsky:
logP: 1.622
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 79
Number of rings: 3

     

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