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P-426527303

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Name File
SDF P-426527303.sdf
SMILES P-426527303.smiles
Standard InChI P-426527303.inchi
InChIKey P-426527303.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability Updated
P-426527303 Intermed Ltd. Intermed Screening Compounds (Small amounts in stock) 90 by synthesis May 1, 2017
Property Value
Components 1
Mass 284.337
logP 1.04
H-bond acceptors 7
H-bond donors 1
Rotatable bonds 4
PSA 100.64
RO5 violations 0
RO3 violations 3
Refractivity 72.7242
Atoms 35
Rings 2
Heavy atoms 19
Hydrogen atoms 16
Heteroatoms 8
N/O atoms 7
Inorganic atoms 0
Halogen atoms 0
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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