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P-502345554

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Name File
SDF P-502345554.sdf
SMILES P-502345554.smiles
Standard InChI P-502345554.inchi
InChIKey P-502345554.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-502345554 TimTec Building Block Collection 90 in stock
Property Value
Components 1
Mass 238.279
logP 2.9624
H-bond acceptors 4
H-bond donors 1
Rotatable bonds 7
PSA 55.76
RO5 violations 0
RO3 violations 2
Refractivity 65.6133
Atoms 35
Rings 1
Heavy atoms 17
Hydrogen atoms 18
Heteroatoms 4
N/O atoms 4
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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