COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK088425
Chemical Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-(4-bromophenyl)ethanone
Smiles: Brc1ccc(cc1)CC(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2

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Molecular Weight: 417.3
Empirical Formula: C20H21BrN2O3

Physical State: Dry powder
Available Amount: 347 mg

Lipinsky:
logP: 3.501
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 42
Number of rings: 4

     

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