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P-31152654

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Name File
SDF P-31152654.sdf
SMILES P-31152654.smiles
Standard InChI P-31152654.inchi
InChIKey P-31152654.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-31152654 LaboTest Screening Collection 90 unavailable
Property Value
Components 1
Mass 246.560
logP 2.901
H-bond acceptors 8
H-bond donors 1
Rotatable bonds 3
PSA 128.94
RO5 violations 0
RO3 violations 2
Refractivity 56.0553
Atoms 19
Rings 1
Heavy atoms 16
Hydrogen atoms 3
Heteroatoms 9
N/O atoms 8
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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