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P-505410383

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Name File
SDF P-505410383.sdf
SMILES P-505410383.smiles
Standard InChI P-505410383.inchi
InChIKey P-505410383.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability Updated
P-505410383 BOCSCI All products 90 in stock July 6, 2017
Property Value
Components 2
Mass 417.951
logP 5.3116
H-bond acceptors 7
H-bond donors 3
Rotatable bonds 8
PSA 111.14
RO5 violations 1
RO3 violations 5
Refractivity 111.632
Atoms 55
Rings 2
Heavy atoms 27
Hydrogen atoms 28
Heteroatoms 9
N/O atoms 7
Inorganic atoms 0
Halogen atoms 1
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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