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P-881139362

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Name File
SDF P-881139362.sdf
SMILES P-881139362.smiles
Standard InChI P-881139362.inchi
InChIKey P-881139362.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-881139362 ChemDiv Discovery Chemistry Library 90 in stock
Property Value
Components 1
Mass 358.388
logP 4.1504
H-bond acceptors 5
H-bond donors 2
Rotatable bonds 4
PSA 96.22
RO5 violations 0
RO3 violations 5
Refractivity 100.5507
Atoms 40
Rings 3
Heavy atoms 25
Hydrogen atoms 15
Heteroatoms 7
N/O atoms 5
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 2
Cis/trans stereo double bonds 1
Unknown stereo double bonds 1
Undefined stereo double bonds 0
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