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P-612871303

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Name File
SDF P-612871303.sdf
SMILES P-612871303.smiles
Standard InChI P-612871303.inchi
InChIKey P-612871303.txt
Property Value
Components 1
Mass 174.163
logP 0.46778
H-bond acceptors 6
H-bond donors 1
Rotatable bonds 0
PSA 92.89
RO5 violations 0
RO3 violations 2
Refractivity 44.8674
Atoms 19
Rings 2
Heavy atoms 13
Hydrogen atoms 6
Heteroatoms 6
N/O atoms 6
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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