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P-885536348

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Name File
SDF P-885536348.sdf
SMILES P-885536348.smiles
Standard InChI P-885536348.inchi
InChIKey P-885536348.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-885536348 Princeton Biomolecular Research Building Blocks Synthesis 95 by synthesis
Property Value
Components 1
Mass 211.330
logP 2.5543
H-bond acceptors 3
H-bond donors 2
Rotatable bonds 3
PSA 79.18
RO5 violations 0
RO3 violations 1
Refractivity 61.1731
Atoms 31
Rings 2
Heavy atoms 14
Hydrogen atoms 17
Heteroatoms 4
N/O atoms 3
Inorganic atoms 0
Halogen atoms 0
Chiral centers 1
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 1
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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