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P-868520127

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Name File
SDF P-868520127.sdf
SMILES P-868520127.smiles
Standard InChI P-868520127.inchi
InChIKey P-868520127.txt
Property Value
Components 1
Mass 535.659
logP 6.4937
H-bond acceptors 9
H-bond donors 4
Rotatable bonds 8
PSA 127.96
RO5 violations 2
RO3 violations 6
Refractivity 154.9919
Atoms 71
Rings 5
Heavy atoms 38
Hydrogen atoms 33
Heteroatoms 10
N/O atoms 9
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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