COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK129908
Chemical Name: 3-methyl-1-[4-(2,3,4-trimethoxybenzyl)piperazin-1-yl]butan-1-one
Smiles: COc1c(ccc(c1OC)OC)CN1CCN(CC1)C(=O)CC(C)C

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Saltdata: C2H2O4
Molecular Weight: 350.46
Empirical Formula: C19H30N2O4

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 2.005
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 51
Number of rings: 2

     

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