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P-502407393

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Name File
SDF P-502407393.sdf
SMILES P-502407393.smiles
Standard InChI P-502407393.inchi
InChIKey P-502407393.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-502407393 TimTec Building Block Collection 90 in stock
Property Value
Components 1
Mass 249.092
logP 3.92708
H-bond acceptors 2
H-bond donors 0
Rotatable bonds 1
PSA 36.68
RO5 violations 0
RO3 violations 1
Refractivity 64.408
Atoms 22
Rings 2
Heavy atoms 16
Hydrogen atoms 6
Heteroatoms 4
N/O atoms 2
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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