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P-580451422

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Name File
SDF P-580451422.sdf
SMILES P-580451422.smiles
Standard InChI P-580451422.inchi
InChIKey P-580451422.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-580451422 CliniSciences S.A.S All products 98 in stock
Property Value
Components 1
Mass 185.185
logP 1.6695
H-bond acceptors 5
H-bond donors 2
Rotatable bonds 0
PSA 80.48
RO5 violations 0
RO3 violations 2
Refractivity 53.5941
Atoms 21
Rings 3
Heavy atoms 14
Hydrogen atoms 7
Heteroatoms 5
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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