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P-596488536

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Name File
SDF P-596488536.sdf
SMILES P-596488536.smiles
Standard InChI P-596488536.inchi
InChIKey P-596488536.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-596488536 Asinex General bb catalog 90 unavailable
Property Value
Components 1
Mass 282.361
logP 2.1851
H-bond acceptors 5
H-bond donors 2
Rotatable bonds 7
PSA 87.14
RO5 violations 0
RO3 violations 3
Refractivity 77.3975
Atoms 37
Rings 2
Heavy atoms 19
Hydrogen atoms 18
Heteroatoms 6
N/O atoms 5
Inorganic atoms 0
Halogen atoms 0
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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