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P-22258740

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Name File
SDF P-22258740.sdf
SMILES P-22258740.smiles
Standard InChI P-22258740.inchi
InChIKey P-22258740.txt
Property Value
Components 1
Mass 376.494
logP 4.0236
H-bond acceptors 5
H-bond donors 2
Rotatable bonds 7
PSA 61.02
RO5 violations 0
RO3 violations 5
Refractivity 116.5084
Atoms 56
Rings 4
Heavy atoms 28
Hydrogen atoms 28
Heteroatoms 5
N/O atoms 5
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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