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P-12672550

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Name File
SDF P-12672550.sdf
SMILES P-12672550.smiles
Standard InChI P-12672550.inchi
InChIKey P-12672550.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-12672550 InterBioScreen Screening Compounds 92 unavailable
Property Value
Components 1
Mass 243.261
logP 2.54838
H-bond acceptors 5
H-bond donors 1
Rotatable bonds 4
PSA 71.08
RO5 violations 0
RO3 violations 3
Refractivity 66.4687
Atoms 31
Rings 2
Heavy atoms 18
Hydrogen atoms 13
Heteroatoms 5
N/O atoms 5
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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