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UNKNOWN STEREO

P-855008852

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Name File
SDF P-855008852.sdf
SMILES P-855008852.smiles
Standard InChI P-855008852.inchi
InChIKey P-855008852.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-855008852 Toronto Research In stock 90 in stock
Property Value
Components 1
Mass 676.660
logP 0.0679
H-bond acceptors 15
H-bond donors 8
Rotatable bonds 9
PSA 238.2
RO5 violations 3
RO3 violations 5
Refractivity 167.2836
Atoms 88
Rings 5
Heavy atoms 48
Hydrogen atoms 40
Heteroatoms 15
N/O atoms 15
Inorganic atoms 0
Halogen atoms 0
Chiral centers 10
R/S chiral centers 10
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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