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P-852147309

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Name File
SDF P-852147309.sdf
SMILES P-852147309.smiles
Standard InChI P-852147309.inchi
InChIKey P-852147309.txt
Property Value
Components 1
Mass 279.360
logP 2.2278
H-bond acceptors 5
H-bond donors 3
Rotatable bonds 9
PSA 94.48
RO5 violations 0
RO3 violations 3
Refractivity 77.8571
Atoms 36
Rings 1
Heavy atoms 19
Hydrogen atoms 17
Heteroatoms 6
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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