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MCULE-3479281612

Compound Show structure
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  1. InChIKey:
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  1. 1
    1. MCULE-8770145541

    2. Component type: Main
  2. 1
    1. MCULE-6647815245

    2. Component type: Counter Ion
Property Value
Components 2
Mass 379.490
logP 3.9021
H-bond acceptors 6
H-bond donors 2
Rotatable bonds 9
PSA 87.07
RO5 violations 0
RO3 violations 5
Refractivity 110.7456
Atoms 60
Rings 2
Heavy atoms 27
Hydrogen atoms 33
Heteroatoms 6
N/O atoms 6
Inorganic atoms 0
Halogen atoms 0
Chiral centers 1
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 1
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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