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P-33820922

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Name File
SDF P-33820922.sdf
SMILES P-33820922.smiles
Standard InChI P-33820922.inchi
InChIKey P-33820922.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-33820922 TimTec ActiMol 6 Week 90 in stock
Property Value
Components 1
Mass 458.562
logP 4.0399
H-bond acceptors 9
H-bond donors 2
Rotatable bonds 11
PSA 178.56
RO5 violations 0
RO3 violations 5
Refractivity 122.5436
Atoms 53
Rings 3
Heavy atoms 31
Hydrogen atoms 22
Heteroatoms 11
N/O atoms 9
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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