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UNKNOWN STEREO

P-855309085

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Name File
SDF P-855309085.sdf
SMILES P-855309085.smiles
Standard InChI P-855309085.inchi
InChIKey P-855309085.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-855309085 Toronto Research In stock 90 in stock
Property Value
Components 1
Mass 337.410
logP 1.2106
H-bond acceptors 6
H-bond donors 1
Rotatable bonds 0
PSA 76.07
RO5 violations 0
RO3 violations 3
Refractivity 92.4048
Atoms 51
Rings 3
Heavy atoms 24
Hydrogen atoms 27
Heteroatoms 6
N/O atoms 6
Inorganic atoms 0
Halogen atoms 0
Chiral centers 5
R/S chiral centers 5
Unknown chiral centers 0
Undefined chiral centers 0
Stereo double bonds 1
Cis/trans stereo double bonds 0
Unknown stereo double bonds 1
Undefined stereo double bonds 0
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