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P-482482683

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Name File
SDF P-482482683.sdf
SMILES P-482482683.smiles
Standard InChI P-482482683.inchi
InChIKey P-482482683.txt
Property Value
Components 1
Mass 427.518
logP 4.085
H-bond acceptors 7
H-bond donors 1
Rotatable bonds 8
PSA 105.53
RO5 violations 0
RO3 violations 5
Refractivity 123.7987
Atoms 55
Rings 3
Heavy atoms 30
Hydrogen atoms 25
Heteroatoms 8
N/O atoms 7
Inorganic atoms 0
Halogen atoms 0
Chiral centers 1
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 1
Stereo double bonds 1
Cis/trans stereo double bonds 0
Unknown stereo double bonds 1
Undefined stereo double bonds 0
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