COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK145081
Chemical Name: 1-(3,4-dimethoxybenzyl)-4-(4,5-dimethoxy-2-nitrobenzyl)piperazine
Smiles: COc1cc(ccc1OC)CN1CCN(CC1)Cc1cc(OC)c(cc1[N+](=O)[O-])OC

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Molecular Weight: 431.49
Empirical Formula: C22H29N3O6

Physical State: Dry powder
Available Amount: 140 mg

Lipinsky:
logP: 2.127
Rotatable bonds: 6
H-donors: 0
H-acceptors: 6
PSA: 89
Number of rings: 3

     

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