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P-580292483

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Name File
SDF P-580292483.sdf
SMILES P-580292483.smiles
Standard InChI P-580292483.inchi
InChIKey P-580292483.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-580292483 Debye Scientific General Catalog N/A by resynthesis (? - ? days)
Property Value
Components 1
Mass 246.686
logP 3.7315
H-bond acceptors 2
H-bond donors 0
Rotatable bonds 4
PSA 26.3
RO5 violations 0
RO3 violations 2
Refractivity 67.8185
Atoms 28
Rings 2
Heavy atoms 17
Hydrogen atoms 11
Heteroatoms 3
N/O atoms 2
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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