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UNKNOWN STEREO

MCULE-5461012814-0

Structure Show compound
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  1. InChIKey:
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  3. Formula:
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  1. 1
    UNK
    1. MCULE-2315819313-0

    2. Component type: Main
  2. 1
    1. MCULE-5889111640-1

    2. Component type: Counter Ion
Property Value
Components 2
Mass 587.627
logP 3.8381
H-bond acceptors 10
H-bond donors 3
Rotatable bonds 10
PSA 138.29
RO5 violations 1
RO3 violations 5
Refractivity 146.3493
Atoms 81
Rings 4
Heavy atoms 41
Hydrogen atoms 40
Heteroatoms 13
N/O atoms 10
Inorganic atoms 0
Halogen atoms 3
Chiral centers 4
R/S chiral centers 4
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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