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P-31162342

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Name File
SDF P-31162342.sdf
SMILES P-31162342.smiles
Standard InChI P-31162342.inchi
InChIKey P-31162342.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-31162342 LaboTest Screening Collection 90 unavailable
Property Value
Components 1
Mass 235.060
logP 2.8453
H-bond acceptors 3
H-bond donors 1
Rotatable bonds 3
PSA 46.53
RO5 violations 0
RO3 violations 0
Refractivity 54.3398
Atoms 22
Rings 1
Heavy atoms 14
Hydrogen atoms 8
Heteroatoms 5
N/O atoms 3
Inorganic atoms 0
Halogen atoms 2
Chiral centers 1
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 1
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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