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MCULE-6582622554-0

Structure Show compound
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  1. InChIKey:
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  3. Formula:
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  1. 1
    1. MCULE-5867150114-0

    2. Component type: Main
  2. 1
    1. MCULE-4094049864-0

    2. Component type: Counter Ion
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-502769626 Innovapharm Screening Compounds 90 As is in stock
P-854152225 InterBioScreen Screening Compounds 92 As is unavailable
Property Value
Components 2
Mass 419.968
logP 4.77768
H-bond acceptors 5
H-bond donors 2
Rotatable bonds 4
PSA 78.73
RO5 violations 0
RO3 violations 5
Refractivity 122.3921
Atoms 54
Rings 3
Heavy atoms 28
Hydrogen atoms 26
Heteroatoms 7
N/O atoms 5
Inorganic atoms 0
Halogen atoms 1
Chiral centers 1
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 1
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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