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P-425272366

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Name File
SDF P-425272366.sdf
SMILES P-425272366.smiles
Standard InChI P-425272366.inchi
InChIKey P-425272366.txt
Property Value
Components 1
Mass 409.560
logP 5.4228
H-bond acceptors 4
H-bond donors 0
Rotatable bonds 9
PSA 38.77
RO5 violations 1
RO3 violations 4
Refractivity 122.176
Atoms 65
Rings 3
Heavy atoms 30
Hydrogen atoms 35
Heteroatoms 4
N/O atoms 4
Inorganic atoms 0
Halogen atoms 0
Chiral centers 2
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 2
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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