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P-578507830

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Name File
SDF P-578507830.sdf
SMILES P-578507830.smiles
Standard InChI P-578507830.inchi
InChIKey P-578507830.txt
Property Value
Components 1
Mass 394.373
logP 3.1727
H-bond acceptors 6
H-bond donors 1
Rotatable bonds 6
PSA 68.92
RO5 violations 0
RO3 violations 5
Refractivity 103.6107
Atoms 45
Rings 4
Heavy atoms 29
Hydrogen atoms 16
Heteroatoms 8
N/O atoms 6
Inorganic atoms 0
Halogen atoms 2
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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