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P-869175892

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Name File
SDF P-869175892.sdf
SMILES P-869175892.smiles
Standard InChI P-869175892.inchi
InChIKey P-869175892.txt
Property Value
Components 1
Mass 164.200
logP 2.2648
H-bond acceptors 2
H-bond donors 1
Rotatable bonds 3
PSA 37.3
RO5 violations 0
RO3 violations 0
Refractivity 47.6008
Atoms 24
Rings 1
Heavy atoms 12
Hydrogen atoms 12
Heteroatoms 2
N/O atoms 2
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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