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P-9974069

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Name File
SDF P-9974069.sdf
SMILES P-9974069.smiles
Standard InChI P-9974069.inchi
InChIKey P-9974069.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-9974069 ChemDiv Discovery Chemistry Library 90 unavailable
Property Value
Components 1
Mass 366.452
logP 3.0398
H-bond acceptors 5
H-bond donors 1
Rotatable bonds 8
PSA 58.64
RO5 violations 0
RO3 violations 4
Refractivity 108.9007
Atoms 53
Rings 3
Heavy atoms 27
Hydrogen atoms 26
Heteroatoms 5
N/O atoms 5
Inorganic atoms 0
Halogen atoms 0
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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