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MCULE-3992334766

Compound Show structure
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Property Value
Components 1
Mass 459.454
logP 5.0758
H-bond acceptors 4
H-bond donors 1
Rotatable bonds 6
PSA 100.01
RO5 violations 1
RO3 violations 5
Refractivity 120.4327
Atoms 52
Rings 4
Heavy atoms 28
Hydrogen atoms 24
Heteroatoms 8
N/O atoms 4
Inorganic atoms 0
Halogen atoms 2
Chiral centers 3
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 3
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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