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P-579714315

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Name File
SDF P-579714315.sdf
SMILES P-579714315.smiles
Standard InChI P-579714315.inchi
InChIKey P-579714315.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-579714315 Paragos In-stock compounds N/A in stock
Property Value
Components 2
Mass 563.636
logP 4.7476
H-bond acceptors 9
H-bond donors 4
Rotatable bonds 13
PSA 144.6
RO5 violations 1
RO3 violations 6
Refractivity 157.1932
Atoms 78
Rings 3
Heavy atoms 41
Hydrogen atoms 37
Heteroatoms 9
N/O atoms 9
Inorganic atoms 0
Halogen atoms 0
Chiral centers 0
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 0
Stereo double bonds 1
Cis/trans stereo double bonds 1
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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