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MCULE-5107650193

Compound Show structure
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Property Value
Components 1
Mass 532.673
logP 3.8921
H-bond acceptors 8
H-bond donors 1
Rotatable bonds 9
PSA 82.19
RO5 violations 1
RO3 violations 5
Refractivity 161.8582
Atoms 79
Rings 5
Heavy atoms 39
Hydrogen atoms 40
Heteroatoms 8
N/O atoms 8
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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