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P-505446501

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Name File
SDF P-505446501.sdf
SMILES P-505446501.smiles
Standard InChI P-505446501.inchi
InChIKey P-505446501.txt
Property Value
Components 1
Mass 248.277
logP 1.9516
H-bond acceptors 5
H-bond donors 3
Rotatable bonds 5
PSA 74.35
RO5 violations 0
RO3 violations 3
Refractivity 69.2024
Atoms 34
Rings 2
Heavy atoms 18
Hydrogen atoms 16
Heteroatoms 5
N/O atoms 5
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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