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P-12863335

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Name File
SDF P-12863335.sdf
SMILES P-12863335.smiles
Standard InChI P-12863335.inchi
InChIKey P-12863335.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-12863335 InterBioScreen Screening Compounds 92 unavailable
Property Value
Components 1
Mass 420.228
logP 3.0967
H-bond acceptors 5
H-bond donors 2
Rotatable bonds 5
PSA 77.84
RO5 violations 0
RO3 violations 5
Refractivity 99.9731
Atoms 41
Rings 3
Heavy atoms 26
Hydrogen atoms 15
Heteroatoms 7
N/O atoms 5
Inorganic atoms 0
Halogen atoms 2
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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