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MCULE-4549136878

Compound Show structure
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  1. InChIKey:
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  3. Formula:
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  1. 2
    1. MCULE-9976402631

    2. Component type: Counter Ion
  2. 1
    1. MCULE-1431015236

    2. Component type: Unknown
Property Value
Components 3
Mass 244.089
logP 1.9027
H-bond acceptors 4
H-bond donors 2
Rotatable bonds 2
PSA 74.6
RO5 violations 0
RO3 violations 2
Refractivity 34.3026
Atoms 21
Rings 0
Heavy atoms 15
Hydrogen atoms 6
Heteroatoms 10
N/O atoms 4
Inorganic atoms 0
Halogen atoms 6
Chiral centers 0
R/S chiral centers 0
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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