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P-869079841

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Name File
SDF P-869079841.sdf
SMILES P-869079841.smiles
Standard InChI P-869079841.inchi
InChIKey P-869079841.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-869079841 MedChemExpress Building Blocks on demand 95 by synthesis
Property Value
Components 2
Mass 462.320
logP 3.6643
H-bond acceptors 1
H-bond donors 0
Rotatable bonds 2
PSA 13.14
RO5 violations 0
RO3 violations 2
Refractivity 122.373
Atoms 46
Rings 5
Heavy atoms 27
Hydrogen atoms 19
Heteroatoms 2
N/O atoms 1
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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