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P-480163153

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Name File
SDF P-480163153.sdf
SMILES P-480163153.smiles
Standard InChI P-480163153.inchi
InChIKey P-480163153.txt
Property Value
Components 1
Mass 366.834
logP 5.5051
H-bond acceptors 3
H-bond donors 1
Rotatable bonds 2
PSA 54.37
RO5 violations 1
RO3 violations 2
Refractivity 102.0398
Atoms 45
Rings 4
Heavy atoms 26
Hydrogen atoms 19
Heteroatoms 4
N/O atoms 3
Inorganic atoms 0
Halogen atoms 1
Chiral centers 2
R/S chiral centers 2
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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