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MCULE-3551548141

Compound Show structure
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  1. InChIKey:
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  1. 1
    1. MCULE-7613139900

    2. Component type: Main
  2. 1
    1. MCULE-7728164114

    2. Component type: Counter Ion
  3. 1
    1. MCULE-7903544426

    2. Component type: Counter Ion
Property Value
Components 3
Mass 388.884
logP 2.6245
H-bond acceptors 7
H-bond donors 2
Rotatable bonds 9
PSA 95.94
RO5 violations 0
RO3 violations 4
Refractivity 102.54
Atoms 55
Rings 1
Heavy atoms 26
Hydrogen atoms 29
Heteroatoms 8
N/O atoms 7
Inorganic atoms 0
Halogen atoms 1
Chiral centers 2
R/S chiral centers 0
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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