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UNKNOWN STEREO

MCULE-7938922292

Compound Show structure
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  1. InChIKey:
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  3. Formula:
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  1. 1
    UNK
    1. MCULE-5045903336

    2. Component type: Main
  2. 1
    1. MCULE-5396813937

    2. Component type: Counter Ion
Property Value
Components 2
Mass 509.485
logP -1.1269
H-bond acceptors 14
H-bond donors 5
Rotatable bonds 11
PSA 230.95
RO5 violations 2
RO3 violations 5
Refractivity 115.4497
Atoms 54
Rings 3
Heavy atoms 35
Hydrogen atoms 19
Heteroatoms 15
N/O atoms 14
Inorganic atoms 1
Halogen atoms 0
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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