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MCULE-8516322862-0

Structure Show compound
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  1. InChIKey:
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  3. Formula:
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  1. 1
    1. MCULE-4495871807-0

    2. Component type: Main
  2. 1
    1. MCULE-2361956978-0

    2. Component type: Counter Ion
  3. 1
    1. MCULE-5932450224-0

    2. Component type: Counter Ion
Property Value
Components 3
Mass 227.078
logP 3.0845
H-bond acceptors 1
H-bond donors 1
Rotatable bonds 4
PSA 12.03
RO5 violations 0
RO3 violations 2
Refractivity 48.1497
Atoms 24
Rings 1
Heavy atoms 14
Hydrogen atoms 10
Heteroatoms 6
N/O atoms 1
Inorganic atoms 1
Halogen atoms 3
Chiral centers 0
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 0
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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