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MCULE-4749466582

Compound Show structure
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Property Value
Components 1
Mass 402.445
logP 2.2659
H-bond acceptors 7
H-bond donors 3
Rotatable bonds 5
PSA 94.3
RO5 violations 0
RO3 violations 4
Refractivity 119.1306
Atoms 52
Rings 5
Heavy atoms 30
Hydrogen atoms 22
Heteroatoms 7
N/O atoms 7
Inorganic atoms 0
Halogen atoms 0
Chiral centers 3
R/S chiral centers 3
Unknown chiral centers 0
Undefined chiral centers 0
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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