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MCULE-2033616638-0

Structure Show compound
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  1. InChIKey:
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  3. Formula:
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  1. 1
    1. MCULE-2308875813-1

    2. Component type: Main
  2. 2
    1. MCULE-3833394421-0

    2. Component type: Counter Ion
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-863616251 Georganics Ltd. On request 97 As is by synthesis
P-860795407 Manchester Organics Compounds on demand N/A As is by synthesis
P-593463469 Otava Virtual BB 95 As is by synthesis
P-855354216 Toronto Research In stock 90 As is in stock
Property Value
Components 3
Mass 176.035
logP -3.7464
H-bond acceptors 5
H-bond donors 0
Rotatable bonds 2
PSA 92.79
RO5 violations 0
RO3 violations 2
Refractivity 19.972
Atoms 13
Rings 1
Heavy atoms 11
Hydrogen atoms 2
Heteroatoms 7
N/O atoms 5
Inorganic atoms 2
Halogen atoms 0
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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