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P-500374859

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Name File
SDF P-500374859.sdf
SMILES P-500374859.smiles
Standard InChI P-500374859.inchi
InChIKey P-500374859.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-500374859 Pi Chemicals Virtual Compounds 98 by synthesis
Property Value
Components 2
Mass 367.800
logP 2.7791
H-bond acceptors 6
H-bond donors 2
Rotatable bonds 3
PSA 74.57
RO5 violations 0
RO3 violations 3
Refractivity 102.211
Atoms 44
Rings 4
Heavy atoms 25
Hydrogen atoms 19
Heteroatoms 8
N/O atoms 6
Inorganic atoms 0
Halogen atoms 2
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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