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P-885522531

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Name File
SDF P-885522531.sdf
SMILES P-885522531.smiles
Standard InChI P-885522531.inchi
InChIKey P-885522531.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-885522531 Princeton Biomolecular Research Building Blocks Synthesis 95 by synthesis
Property Value
Components 1
Mass 242.228
logP -1.5143
H-bond acceptors 7
H-bond donors 3
Rotatable bonds 2
PSA 104.55
RO5 violations 0
RO3 violations 2
Refractivity 58.0733
Atoms 31
Rings 2
Heavy atoms 17
Hydrogen atoms 14
Heteroatoms 7
N/O atoms 7
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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