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MCULE-8827965631

Compound Show structure
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Property Value
Components 1
Mass 398.452
logP 5.1259
H-bond acceptors 5
H-bond donors 2
Rotatable bonds 7
PSA 63.35
RO5 violations 1
RO3 violations 5
Refractivity 115.7244
Atoms 52
Rings 5
Heavy atoms 30
Hydrogen atoms 22
Heteroatoms 5
N/O atoms 5
Inorganic atoms 0
Halogen atoms 0
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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