COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK194887
Chemical Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(3-bromo-4-methoxybenzyl)piperazine
Smiles: COc1ccc(cc1Br)CN1CCN(CC1)Cc1ccc2c(c1)OCO2

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Saltdata: C2H2O4
Molecular Weight: 419.32
Empirical Formula: C20H23BrN2O3

Physical State: Dry powder
Available Amount: 133 mg

Lipinsky:
logP: 2.801
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 34
Number of rings: 4

     

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