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P-25771241

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Name File
SDF P-25771241.sdf
SMILES P-25771241.smiles
Standard InChI P-25771241.inchi
InChIKey P-25771241.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-25771241 Life Chemicals Screening Compounds 90 in stock
Property Value
Components 2
Mass 540.604
logP 5.9296
H-bond acceptors 8
H-bond donors 3
Rotatable bonds 10
PSA 128.46
RO5 violations 2
RO3 violations 5
Refractivity 141.9198
Atoms 67
Rings 4
Heavy atoms 38
Hydrogen atoms 29
Heteroatoms 10
N/O atoms 8
Inorganic atoms 0
Halogen atoms 1
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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