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P-500382702

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Name File
SDF P-500382702.sdf
SMILES P-500382702.smiles
Standard InChI P-500382702.inchi
InChIKey P-500382702.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-500382702 Pi Chemicals Virtual Compounds 98 by synthesis
Property Value
Components 1
Mass 121.932
logP -0.6336
H-bond acceptors 2
H-bond donors 2
Rotatable bonds 1
PSA 40.46
RO5 violations 0
RO3 violations 0
Refractivity 36.2676
Atoms 16
Rings 1
Heavy atoms 9
Hydrogen atoms 7
Heteroatoms 3
N/O atoms 2
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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