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P-885534972

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Name File
SDF P-885534972.sdf
SMILES P-885534972.smiles
Standard InChI P-885534972.inchi
InChIKey P-885534972.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-885534972 Princeton Biomolecular Research Building Blocks Synthesis 95 by synthesis
Property Value
Components 2
Mass 313.862
logP 4.9706
H-bond acceptors 1
H-bond donors 0
Rotatable bonds 3
PSA 3.24
RO5 violations 0
RO3 violations 2
Refractivity 97.927
Atoms 46
Rings 3
Heavy atoms 22
Hydrogen atoms 24
Heteroatoms 2
N/O atoms 1
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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