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P-579714304

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Name File
SDF P-579714304.sdf
SMILES P-579714304.smiles
Standard InChI P-579714304.inchi
InChIKey P-579714304.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-579714304 Paragos In-stock compounds N/A in stock
Property Value
Components 2
Mass 434.406
logP 3.6136
H-bond acceptors 8
H-bond donors 3
Rotatable bonds 12
PSA 131.44
RO5 violations 0
RO3 violations 5
Refractivity 103.033
Atoms 55
Rings 1
Heavy atoms 30
Hydrogen atoms 25
Heteroatoms 11
N/O atoms 8
Inorganic atoms 0
Halogen atoms 3
Chiral centers 0
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 0
Stereo double bonds 2
Cis/trans stereo double bonds 2
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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