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MCULE-4801636791-0

Structure Show compound
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  1. InChIKey:
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  1. 1
    1. MCULE-1379121318-0

    2. Component type: Main
  2. 1
    1. MCULE-6124492894-1

    2. Component type: Counter Ion
Property Value
Components 2
Mass 401.303
logP 4.7349
H-bond acceptors 5
H-bond donors 2
Rotatable bonds 6
PSA 131.84
RO5 violations 0
RO3 violations 5
Refractivity 93.0695
Atoms 35
Rings 3
Heavy atoms 22
Hydrogen atoms 13
Heteroatoms 8
N/O atoms 5
Inorganic atoms 0
Halogen atoms 1
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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