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P-610889208

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Name File
SDF P-610889208.sdf
SMILES P-610889208.smiles
Standard InChI P-610889208.inchi
InChIKey P-610889208.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-610889208 Advanced ChemBlocks Inc (AChemBlock) On demand 90 by synthesis
Property Value
Components 2
Mass 494.388
logP 5.675
H-bond acceptors 3
H-bond donors 0
Rotatable bonds 6
PSA 79.17
RO5 violations 1
RO3 violations 4
Refractivity 111.8064
Atoms 49
Rings 3
Heavy atoms 32
Hydrogen atoms 17
Heteroatoms 11
N/O atoms 3
Inorganic atoms 0
Halogen atoms 6
Chiral centers 0
R/S chiral centers 0
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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