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MCULE-3708034445-0

Structure Show compound
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  1. 1
    1. MCULE-8358394750-0

    2. Component type: Main
  2. 1
    1. MCULE-9920754312-0

    2. Component type: Counter Ion
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability Updated
P-18787361 Key Organics Screening Compounds and Fragments 90 As is unavailable Monday
P-851552479 AmBeed On request 90 Main component by synthesis April 1
P-611059499 BLD pharm Non-stock building blocks 90 Main component by synthesis July 29
Property Value
Components 2
Mass 423.436
logP 3.5561
H-bond acceptors 7
H-bond donors 3
Rotatable bonds 4
PSA 102.76
RO5 violations 0
RO3 violations 5
Refractivity 122.9073
Atoms 53
Rings 4
Heavy atoms 31
Hydrogen atoms 22
Heteroatoms 8
N/O atoms 7
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 1
Cis/trans stereo double bonds 0
Unknown stereo double bonds 1
Undefined stereo double bonds 0
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