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P-618656590

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Name File
SDF P-618656590.sdf
SMILES P-618656590.smiles
Standard InChI P-618656590.inchi
InChIKey P-618656590.txt
Property Value
Components 1
Mass 303.762
logP 2.844
H-bond acceptors 5
H-bond donors 1
Rotatable bonds 3
PSA 83.06
RO5 violations 0
RO3 violations 3
Refractivity 75.0498
Atoms 33
Rings 2
Heavy atoms 19
Hydrogen atoms 14
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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