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P-860644575

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Name File
SDF P-860644575.sdf
SMILES P-860644575.smiles
Standard InChI P-860644575.inchi
InChIKey P-860644575.txt
Property Value
Components 2
Mass 323.641
logP 2.9008
H-bond acceptors 3
H-bond donors 0
Rotatable bonds 4
PSA 23.55
RO5 violations 0
RO3 violations 2
Refractivity 88.729
Atoms 36
Rings 2
Heavy atoms 19
Hydrogen atoms 17
Heteroatoms 6
N/O atoms 3
Inorganic atoms 0
Halogen atoms 3
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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