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MCULE-6857024600-1

Structure Show compound
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  1. InChIKey:
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    1. MCULE-8604674513-0

    2. Component type: Main
    1. MCULE-3112878966-0

    2. Component type: Main
    1. MCULE-5742072554-0

    2. Component type: Main
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-504021601 Innovapharm Virtual Screening Compounds 90 As a main component by synthesis
P-504022018 Innovapharm Virtual Screening Compounds 90 As a main component by synthesis
P-504022420 Innovapharm Virtual Screening Compounds 90 As a main component by synthesis
Property Value
Components 1
Mass 155.214
logP 1.0968
H-bond acceptors 2
H-bond donors 0
Rotatable bonds 3
PSA 40.13
RO5 violations 0
RO3 violations 0
Refractivity 43.0925
Atoms 26
Rings 1
Heavy atoms 11
Hydrogen atoms 15
Heteroatoms 2
N/O atoms 2
Inorganic atoms 0
Halogen atoms 0
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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