COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL059123
Chemical Name: N,N-dibutyl-4-hydroxy-N-(3-phenylprop-2-yn-1-yl)but-2-yn-1-aminium
Smiles: CCCC[N+](CC#CCO)(CC#Cc1ccccc1)CCCC

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Saltdata: Br-
Molecular Weight: 312.48
Empirical Formula: C21H30NO

Physical State: Dry powder
Available Amount: 325 mg

Lipinsky:
logP: 0.847
Rotatable bonds: 9
H-donors: 1
H-acceptors: 1
PSA: 20
Number of rings: 1

     

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