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P-500376493

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Name File
SDF P-500376493.sdf
SMILES P-500376493.smiles
Standard InChI P-500376493.inchi
InChIKey P-500376493.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-500376493 Pi Chemicals Virtual Compounds 98 by synthesis
Property Value
Components 3
Mass 152.149
logP -1.9812
H-bond acceptors 6
H-bond donors 2
Rotatable bonds 3
PSA 80.26
RO5 violations 0
RO3 violations 2
Refractivity 32.9706
Atoms 22
Rings 0
Heavy atoms 10
Hydrogen atoms 12
Heteroatoms 6
N/O atoms 6
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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