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P-491217959

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Name File
SDF P-491217959.sdf
SMILES P-491217959.smiles
Standard InChI P-491217959.inchi
InChIKey P-491217959.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-491217959 Princeton Biomolecular Research Building Blocks Synthesis 95 by synthesis
Property Value
Components 1
Mass 261.341
logP 3.3624
H-bond acceptors 3
H-bond donors 1
Rotatable bonds 3
PSA 78.43
RO5 violations 0
RO3 violations 2
Refractivity 73.9928
Atoms 33
Rings 2
Heavy atoms 18
Hydrogen atoms 15
Heteroatoms 4
N/O atoms 3
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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