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P-489168921

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Name File
SDF P-489168921.sdf
SMILES P-489168921.smiles
Standard InChI P-489168921.inchi
InChIKey P-489168921.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-489168921 Amadis Chemical Company Limited Amadis Chemical General Catalog 97 in stock
Property Value
Components 2
Mass 504.493
logP 0.23418
H-bond acceptors 14
H-bond donors 5
Rotatable bonds 9
PSA 221.04
RO5 violations 2
RO3 violations 5
Refractivity 128.6689
Atoms 64
Rings 3
Heavy atoms 36
Hydrogen atoms 28
Heteroatoms 14
N/O atoms 14
Inorganic atoms 0
Halogen atoms 0
Chiral centers 2
R/S chiral centers 2
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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