COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL059079
Chemical Name: 1-[2-(octanoyloxy)-3-(2-oxopyrrolidin-1-yl)propyl]azepanium
Smiles: CCCCCCCC(=O)OC(CN1CCCC1=O)C[NH+]1CCCCCC1

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Saltdata: Cl-
Molecular Weight: 367.55
Empirical Formula: C21H39N2O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.387
Rotatable bonds: 12
H-donors: 1
H-acceptors: 3
PSA: 51
Number of rings: 2

     

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