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UNKNOWN STEREO

MCULE-7441662640-0

Structure Show compound
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  1. InChIKey:
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  3. Formula:
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  1. 1
    UNK
    1. MCULE-9276942666-0

    2. Component type: Main
  2. 2
    1. MCULE-3743781291-1

    2. Component type: Counter Ion
Property Value
Components 3
Mass 521.459
logP 4.0894
H-bond acceptors 15
H-bond donors 5
Rotatable bonds 6
PSA 239.25
RO5 violations 2
RO3 violations 6
Refractivity 124.7181
Atoms 67
Rings 3
Heavy atoms 35
Hydrogen atoms 32
Heteroatoms 16
N/O atoms 15
Inorganic atoms 0
Halogen atoms 0
Chiral centers 3
R/S chiral centers 1
Unknown chiral centers 0
Undefined chiral centers 2
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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