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P-873223433

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Name File
SDF P-873223433.sdf
SMILES P-873223433.smiles
Standard InChI P-873223433.inchi
InChIKey P-873223433.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-873223433 TimTec Building Block Collection 90 in stock
Property Value
Components 1
Mass 272.366
logP 2.6342
H-bond acceptors 5
H-bond donors 3
Rotatable bonds 6
PSA 86.81
RO5 violations 0
RO3 violations 3
Refractivity 72.8692
Atoms 38
Rings 1
Heavy atoms 18
Hydrogen atoms 20
Heteroatoms 6
N/O atoms 5
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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