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P-885544610

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Name File
SDF P-885544610.sdf
SMILES P-885544610.smiles
Standard InChI P-885544610.inchi
InChIKey P-885544610.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-885544610 Princeton Biomolecular Research Building Blocks Synthesis 95 by synthesis
Property Value
Components 2
Mass 187.586
logP 0.6116
H-bond acceptors 6
H-bond donors 3
Rotatable bonds 0
PSA 100.45
RO5 violations 0
RO3 violations 2
Refractivity 45.8788
Atoms 18
Rings 2
Heavy atoms 12
Hydrogen atoms 6
Heteroatoms 7
N/O atoms 6
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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