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P-594444071

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Name File
SDF P-594444071.sdf
SMILES P-594444071.smiles
Standard InChI P-594444071.inchi
InChIKey P-594444071.txt
Property Value
Components 1
Mass 378.457
logP 2.496
H-bond acceptors 8
H-bond donors 0
Rotatable bonds 6
PSA 112.5
RO5 violations 0
RO3 violations 4
Refractivity 103.208
Atoms 45
Rings 4
Heavy atoms 27
Hydrogen atoms 18
Heteroatoms 9
N/O atoms 8
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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