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P-854861776

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Name File
SDF P-854861776.sdf
SMILES P-854861776.smiles
Standard InChI P-854861776.inchi
InChIKey P-854861776.txt
Property Value
Components 1
Mass 252.695
logP 2.1287
H-bond acceptors 4
H-bond donors 1
Rotatable bonds 4
PSA 49.41
RO5 violations 0
RO3 violations 2
Refractivity 70.3927
Atoms 30
Rings 2
Heavy atoms 17
Hydrogen atoms 13
Heteroatoms 5
N/O atoms 4
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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