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P-491069993

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Name File
SDF P-491069993.sdf
SMILES P-491069993.smiles
Standard InChI P-491069993.inchi
InChIKey P-491069993.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-491069993 Princeton Biomolecular Research Building Blocks Synthesis 95 by synthesis
Property Value
Components 1
Mass 85.065
logP -0.902
H-bond acceptors 4
H-bond donors 2
Rotatable bonds 0
PSA 61.54
RO5 violations 0
RO3 violations 2
Refractivity 19.2084
Atoms 9
Rings 1
Heavy atoms 6
Hydrogen atoms 3
Heteroatoms 4
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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