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P-580452765

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Name File
SDF P-580452765.sdf
SMILES P-580452765.smiles
Standard InChI P-580452765.inchi
InChIKey P-580452765.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-580452765 CliniSciences S.A.S All products 98 in stock
Property Value
Components 3
Mass 472.873
logP 7.6494
H-bond acceptors 4
H-bond donors 1
Rotatable bonds 9
PSA 37.39
RO5 violations 1
RO3 violations 4
Refractivity 135.3387
Atoms 62
Rings 3
Heavy atoms 30
Hydrogen atoms 32
Heteroatoms 7
N/O atoms 4
Inorganic atoms 0
Halogen atoms 3
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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