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P-885527281

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Name File
SDF P-885527281.sdf
SMILES P-885527281.smiles
Standard InChI P-885527281.inchi
InChIKey P-885527281.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-885527281 Princeton Biomolecular Research Building Blocks Synthesis 95 by synthesis
Property Value
Components 1
Mass 229.274
logP 2.6714
H-bond acceptors 3
H-bond donors 2
Rotatable bonds 1
PSA 49.33
RO5 violations 0
RO3 violations 0
Refractivity 69.7195
Atoms 32
Rings 3
Heavy atoms 17
Hydrogen atoms 15
Heteroatoms 3
N/O atoms 3
Inorganic atoms 0
Halogen atoms 0
Chiral centers 3
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 3
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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