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P-33490687

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Name File
SDF P-33490687.sdf
SMILES P-33490687.smiles
Standard InChI P-33490687.inchi
InChIKey P-33490687.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-33490687 TimTec ActiMol 3 Week 90 in stock
Property Value
Components 1
Mass 396.828
logP 3.3561
H-bond acceptors 8
H-bond donors 1
Rotatable bonds 5
PSA 86.86
RO5 violations 0
RO3 violations 5
Refractivity 106.9892
Atoms 45
Rings 4
Heavy atoms 28
Hydrogen atoms 17
Heteroatoms 9
N/O atoms 8
Inorganic atoms 0
Halogen atoms 1
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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