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MCULE-2044169940

Compound Show structure
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Property Value
Components 1
Mass 438.868
logP 5.4172
H-bond acceptors 4
H-bond donors 1
Rotatable bonds 7
PSA 49.41
RO5 violations 1
RO3 violations 4
Refractivity 112.4832
Atoms 52
Rings 3
Heavy atoms 30
Hydrogen atoms 22
Heteroatoms 8
N/O atoms 4
Inorganic atoms 0
Halogen atoms 4
Chiral centers 2
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 2
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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