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P-505456939

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Name File
SDF P-505456939.sdf
SMILES P-505456939.smiles
Standard InChI P-505456939.inchi
InChIKey P-505456939.txt
Property Value
Components 1
Mass 244.375
logP 3.8292
H-bond acceptors 2
H-bond donors 1
Rotatable bonds 5
PSA 19.03
RO5 violations 0
RO3 violations 2
Refractivity 79.8097
Atoms 42
Rings 2
Heavy atoms 18
Hydrogen atoms 24
Heteroatoms 2
N/O atoms 2
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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