COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL000130
Chemical Name: 2- [(1,3- benzodioxol- 5- ylmethyl)amino]butan- 1- ol
Smiles: CCC(NCc1ccc2c(c1)OCO2)CO

Download SD file Download MOL file View 3D-structure Show MSDS

Molecular Weight: 223.27
Empirical Formula: C12H17NO3

Physical State: Dry powder
Available Amount: 4983 mg

Lipinsky:
logP: 1.86
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 50
Number of rings: 2

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