COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL043315
Chemical Name: (2E)-3-chloro-N,N-dimethyl-N-[2-oxo-2-(2-phenylethoxy)ethyl]but-2-en-1-aminium
Smiles: O=C(C[N+](C/C=C(/Cl)\C)(C)C)OCCc1ccccc1

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Saltdata: Br-
Molecular Weight: 296.82
Empirical Formula: C16H23ClNO2

Physical State: Dry powder
Available Amount: 210 mg

Lipinsky:
logP: 0.888
Rotatable bonds: 7
H-donors: 0
H-acceptors: 2
PSA: 26
Number of rings: 1

     

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