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P-885558411

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Name File
SDF P-885558411.sdf
SMILES P-885558411.smiles
Standard InChI P-885558411.inchi
InChIKey P-885558411.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-885558411 Princeton Biomolecular Research Building Blocks Synthesis 95 by synthesis
Property Value
Components 1
Mass 97.995
logP -0.9286
H-bond acceptors 4
H-bond donors 3
Rotatable bonds 0
PSA 87.57
RO5 violations 0
RO3 violations 2
Refractivity 14.2629
Atoms 8
Rings 0
Heavy atoms 5
Hydrogen atoms 3
Heteroatoms 5
N/O atoms 4
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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