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MCULE-2598350426-0

Structure Show compound
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Property Value
Components 1
Mass 431.403
logP -0.1656
H-bond acceptors 13
H-bond donors 6
Rotatable bonds 6
PSA 193.39
RO5 violations 2
RO3 violations 5
Refractivity 108.666
Atoms 52
Rings 4
Heavy atoms 31
Hydrogen atoms 21
Heteroatoms 13
N/O atoms 13
Inorganic atoms 0
Halogen atoms 0
Chiral centers 4
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 4
Stereo double bonds 1
Cis/trans stereo double bonds 0
Unknown stereo double bonds 1
Undefined stereo double bonds 0
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