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P-491082931

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Name File
SDF P-491082931.sdf
SMILES P-491082931.smiles
Standard InChI P-491082931.inchi
InChIKey P-491082931.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-491082931 Princeton Biomolecular Research Building Blocks Synthesis 95 by synthesis
Property Value
Components 1
Mass 256.260
logP 1.5899
H-bond acceptors 6
H-bond donors 2
Rotatable bonds 6
PSA 83.98
RO5 violations 0
RO3 violations 3
Refractivity 70.1784
Atoms 31
Rings 2
Heavy atoms 19
Hydrogen atoms 12
Heteroatoms 6
N/O atoms 6
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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