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P-864022857

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Name File
SDF P-864022857.sdf
SMILES P-864022857.smiles
Standard InChI P-864022857.inchi
InChIKey P-864022857.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-864022857 MedChemExpress Building Blocks on demand 95 by synthesis
Property Value
Components 1
Mass 223.311
logP 2.2053
H-bond acceptors 3
H-bond donors 2
Rotatable bonds 6
PSA 41.49
RO5 violations 0
RO3 violations 1
Refractivity 65.7775
Atoms 37
Rings 1
Heavy atoms 16
Hydrogen atoms 21
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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