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P-505420387

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Name File
SDF P-505420387.sdf
SMILES P-505420387.smiles
Standard InChI P-505420387.inchi
InChIKey P-505420387.txt
Property Value
Components 1
Mass 114.189
logP 1.6156
H-bond acceptors 2
H-bond donors 2
Rotatable bonds 0
PSA 52.04
RO5 violations 0
RO3 violations 0
Refractivity 34.2568
Atoms 22
Rings 1
Heavy atoms 8
Hydrogen atoms 14
Heteroatoms 2
N/O atoms 2
Inorganic atoms 0
Halogen atoms 0
Chiral centers 2
R/S chiral centers 2
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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