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P-889880117

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Name File
SDF P-889880117.sdf
SMILES P-889880117.smiles
Standard InChI P-889880117.inchi
InChIKey P-889880117.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-889880117 Princeton Biomolecular Research Building Blocks Synthesis 95 by synthesis
Property Value
Components 1
Mass 450.504
logP 5.1621
H-bond acceptors 7
H-bond donors 1
Rotatable bonds 8
PSA 72.5
RO5 violations 1
RO3 violations 5
Refractivity 129.3577
Atoms 60
Rings 5
Heavy atoms 33
Hydrogen atoms 27
Heteroatoms 8
N/O atoms 7
Inorganic atoms 0
Halogen atoms 1
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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