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UNKNOWN STEREO

MCULE-1979888474

Compound Show structure
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  1. InChIKey:
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  3. Formula:
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  1. 1
    UNK
    1. MCULE-6380975155

    2. Component type: Main
  2. 1
    1. MCULE-3833394421

    2. Component type: Counter Ion
Property Value
Components 2
Mass 313.298
logP 2.4031
H-bond acceptors 4
H-bond donors 1
Rotatable bonds 6
PSA 65.3
RO5 violations 0
RO3 violations 4
Refractivity 75.8932
Atoms 39
Rings 2
Heavy atoms 22
Hydrogen atoms 17
Heteroatoms 6
N/O atoms 4
Inorganic atoms 1
Halogen atoms 1
Chiral centers 1
R/S chiral centers 1
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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