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P-22772384

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Name File
SDF P-22772384.sdf
SMILES P-22772384.smiles
Standard InChI P-22772384.inchi
InChIKey P-22772384.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-22772384 TimTec ActiMol 3 Week 90 in stock
Property Value
Components 1
Mass 463.281
logP 4.2726
H-bond acceptors 9
H-bond donors 3
Rotatable bonds 9
PSA 136.61
RO5 violations 0
RO3 violations 5
Refractivity 113.1919
Atoms 48
Rings 2
Heavy atoms 29
Hydrogen atoms 19
Heteroatoms 10
N/O atoms 9
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 1
Cis/trans stereo double bonds 0
Unknown stereo double bonds 1
Undefined stereo double bonds 0
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