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P-852491574

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Name File
SDF P-852491574.sdf
SMILES P-852491574.smiles
Standard InChI P-852491574.inchi
InChIKey P-852491574.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-852491574 Matrix Scientific All N/A in stock
Property Value
Components 2
Mass 453.415
logP 1.79308
H-bond acceptors 9
H-bond donors 2
Rotatable bonds 4
PSA 134.35
RO5 violations 0
RO3 violations 4
Refractivity 112.5352
Atoms 54
Rings 3
Heavy atoms 32
Hydrogen atoms 22
Heteroatoms 12
N/O atoms 9
Inorganic atoms 0
Halogen atoms 3
Chiral centers 1
R/S chiral centers 1
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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