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P-616597008

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Name File
SDF P-616597008.sdf
SMILES P-616597008.smiles
Standard InChI P-616597008.inchi
InChIKey P-616597008.txt
Property Value
Components 1
Mass 288.770
logP 4.0327
H-bond acceptors 3
H-bond donors 1
Rotatable bonds 4
PSA 41.99
RO5 violations 0
RO3 violations 2
Refractivity 82.5097
Atoms 37
Rings 2
Heavy atoms 20
Hydrogen atoms 17
Heteroatoms 4
N/O atoms 3
Inorganic atoms 0
Halogen atoms 1
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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