COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL512642
Chemical Name: 1-(1,3-benzodioxol-5-yl)-4-(dimethylamino)butan-1-one
Smiles: CN(CCCC(=O)c1ccc2c(c1)OCO2)C

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Saltdata: HCl
Molecular Weight: 235.28
Empirical Formula: C13H17NO3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.139
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 38
Number of rings: 2

     

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