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P-503646829

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Name File
SDF P-503646829.sdf
SMILES P-503646829.smiles
Standard InChI P-503646829.inchi
InChIKey P-503646829.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-503646829 Innovapharm Virtual Screening Compounds 90 by synthesis
Property Value
Components 1
Mass 435.926
logP 6.2862
H-bond acceptors 5
H-bond donors 2
Rotatable bonds 5
PSA 113.32
RO5 violations 1
RO3 violations 5
Refractivity 123.0551
Atoms 48
Rings 4
Heavy atoms 30
Hydrogen atoms 18
Heteroatoms 7
N/O atoms 5
Inorganic atoms 0
Halogen atoms 1
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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