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P-852416335

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Name File
SDF P-852416335.sdf
SMILES P-852416335.smiles
Standard InChI P-852416335.inchi
InChIKey P-852416335.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-852416335 Matrix Scientific All N/A in stock
Property Value
Components 2
Mass 405.289
logP 3.3021
H-bond acceptors 6
H-bond donors 4
Rotatable bonds 7
PSA 106.86
RO5 violations 0
RO3 violations 6
Refractivity 79.8751
Atoms 44
Rings 1
Heavy atoms 27
Hydrogen atoms 17
Heteroatoms 12
N/O atoms 6
Inorganic atoms 0
Halogen atoms 6
Chiral centers 2
R/S chiral centers 1
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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