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P-489144003

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Name File
SDF P-489144003.sdf
SMILES P-489144003.smiles
Standard InChI P-489144003.inchi
InChIKey P-489144003.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-489144003 Amadis Chemical Company Limited Amadis Chemical General Catalog 97 in stock
Property Value
Components 2
Mass 508.562
logP 3.2516
H-bond acceptors 9
H-bond donors 6
Rotatable bonds 8
PSA 159.95
RO5 violations 2
RO3 violations 6
Refractivity 141.2388
Atoms 69
Rings 4
Heavy atoms 37
Hydrogen atoms 32
Heteroatoms 9
N/O atoms 9
Inorganic atoms 0
Halogen atoms 0
Chiral centers 1
R/S chiral centers 1
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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