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MCULE-9243891828-0

Structure Show compound
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  1. InChIKey:
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  3. Formula:
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  1. 1
    UNK
    1. MCULE-4370362098-0

    2. Component type: Main
  2. 1
    1. MCULE-3867000095-1

    2. Component type: Counter Ion
Property Value
Components 2
Mass 407.457
logP -0.2248
H-bond acceptors 8
H-bond donors 5
Rotatable bonds 3
PSA 142.56
RO5 violations 0
RO3 violations 4
Refractivity 108.2416
Atoms 58
Rings 4
Heavy atoms 29
Hydrogen atoms 29
Heteroatoms 8
N/O atoms 8
Inorganic atoms 0
Halogen atoms 0
Chiral centers 5
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 5
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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