COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL059414
Chemical Name: (2Z)-3-chloro-N,N-dimethyl-N-[2-oxo-2-(prop-2-yn-1-yloxy)ethyl]but-2-en-1-aminium
Smiles: C#CCOC(=O)C[N+](C/C=C(\Cl)/C)(C)C

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Saltdata: I-
Molecular Weight: 230.71
Empirical Formula: C11H17ClNO2

Physical State: Dry powder
Available Amount: 218 mg

Lipinsky:
logP: -0.684
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 26
Number of rings: 0

     

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