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P-889882083

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Name File
SDF P-889882083.sdf
SMILES P-889882083.smiles
Standard InChI P-889882083.inchi
InChIKey P-889882083.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-889882083 Princeton Biomolecular Research Building Blocks Synthesis 95 by synthesis
Property Value
Components 1
Mass 446.544
logP 4.5745
H-bond acceptors 8
H-bond donors 1
Rotatable bonds 9
PSA 77.33
RO5 violations 0
RO3 violations 5
Refractivity 131.4797
Atoms 63
Rings 4
Heavy atoms 33
Hydrogen atoms 30
Heteroatoms 8
N/O atoms 8
Inorganic atoms 0
Halogen atoms 0
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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