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P-488569270

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Name File
SDF P-488569270.sdf
SMILES P-488569270.smiles
Standard InChI P-488569270.inchi
InChIKey P-488569270.txt
Property Value
Components 1
Mass 233.292
logP 1.71968
H-bond acceptors 4
H-bond donors 1
Rotatable bonds 3
PSA 105.07
RO5 violations 0
RO3 violations 2
Refractivity 61.0124
Atoms 27
Rings 2
Heavy atoms 16
Hydrogen atoms 11
Heteroatoms 5
N/O atoms 4
Inorganic atoms 0
Halogen atoms 0
Chiral centers 0
R/S chiral centers 0
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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