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P-893030012

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Name File
SDF P-893030012.sdf
SMILES P-893030012.smiles
Standard InChI P-893030012.inchi
InChIKey P-893030012.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-893030012 A2B Chem Predominantly Building Block on demand N/A by synthesis
Property Value
Components 1
Mass 275.385
logP 2.5786
H-bond acceptors 3
H-bond donors 1
Rotatable bonds 7
PSA 32.7
RO5 violations 0
RO3 violations 1
Refractivity 86.5478
Atoms 45
Rings 2
Heavy atoms 20
Hydrogen atoms 25
Heteroatoms 3
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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