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P-18284240

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Name File
SDF P-18284240.sdf
SMILES P-18284240.smiles
Standard InChI P-18284240.inchi
InChIKey P-18284240.txt
Property Value
Components 1
Mass 323.752
logP 3.9592
H-bond acceptors 5
H-bond donors 1
Rotatable bonds 3
PSA 80.85
RO5 violations 0
RO3 violations 4
Refractivity 76.1932
Atoms 31
Rings 3
Heavy atoms 21
Hydrogen atoms 10
Heteroatoms 7
N/O atoms 5
Inorganic atoms 0
Halogen atoms 1
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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