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P-874516734

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Name File
SDF P-874516734.sdf
SMILES P-874516734.smiles
Standard InChI P-874516734.inchi
InChIKey P-874516734.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-874516734 ChemDiv Discovery Chemistry Library 90 unavailable
Property Value
Components 1
Mass 520.576
logP 2.6797
H-bond acceptors 10
H-bond donors 1
Rotatable bonds 8
PSA 105.84
RO5 violations 1
RO3 violations 4
Refractivity 148.2408
Atoms 70
Rings 5
Heavy atoms 38
Hydrogen atoms 32
Heteroatoms 10
N/O atoms 10
Inorganic atoms 0
Halogen atoms 0
Chiral centers 1
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 1
Stereo double bonds 1
Cis/trans stereo double bonds 0
Unknown stereo double bonds 1
Undefined stereo double bonds 0
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