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MCULE-1561701504

Compound Show structure
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Property Value
Components 1
Mass 396.453
logP 3.157
H-bond acceptors 5
H-bond donors 0
Rotatable bonds 8
PSA 49.85
RO5 violations 0
RO3 violations 4
Refractivity 111.33
Atoms 54
Rings 4
Heavy atoms 29
Hydrogen atoms 25
Heteroatoms 6
N/O atoms 5
Inorganic atoms 0
Halogen atoms 1
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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