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P-893041164

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Name File
SDF P-893041164.sdf
SMILES P-893041164.smiles
Standard InChI P-893041164.inchi
InChIKey P-893041164.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-893041164 A2B Chem Predominantly Building Block on demand N/A by synthesis
Property Value
Components 1
Mass 440.488
logP 2.7956
H-bond acceptors 8
H-bond donors 2
Rotatable bonds 8
PSA 99.54
RO5 violations 0
RO3 violations 4
Refractivity 123.6363
Atoms 60
Rings 3
Heavy atoms 32
Hydrogen atoms 28
Heteroatoms 8
N/O atoms 8
Inorganic atoms 0
Halogen atoms 0
Chiral centers 1
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 1
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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