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UNKNOWN STEREO

P-855052699

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Name File
SDF P-855052699.sdf
SMILES P-855052699.smiles
Standard InChI P-855052699.inchi
InChIKey P-855052699.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-855052699 Toronto Research In stock 90 in stock
Property Value
Components 2
Mass 449.879
logP 3.6217
H-bond acceptors 8
H-bond donors 0
Rotatable bonds 4
PSA 75.69
RO5 violations 0
RO3 violations 5
Refractivity 116.8415
Atoms 55
Rings 5
Heavy atoms 31
Hydrogen atoms 24
Heteroatoms 9
N/O atoms 8
Inorganic atoms 0
Halogen atoms 1
Chiral centers 2
R/S chiral centers 2
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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