COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL553453
Chemical Name: 5-(1,3-benzodioxol-5-yl)-N,N,N-trimethyl-5-oxopentan-1-aminium
Smiles: O=C(c1ccc2c(c1)OCO2)CCCC[N+](C)(C)C

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Saltdata: Cl-
Molecular Weight: 264.34
Empirical Formula: C15H22NO3

Physical State: Dry powder
Available Amount: 288 mg

Lipinsky:
logP: -2.532
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 35
Number of rings: 2

     

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