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UNKNOWN STEREO

P-502372168

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Name File
SDF P-502372168.sdf
SMILES P-502372168.smiles
Standard InChI P-502372168.inchi
InChIKey P-502372168.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-502372168 TimTec Building Block Collection 90 in stock
Property Value
Components 1
Mass 229.259
logP -0.0129
H-bond acceptors 6
H-bond donors 2
Rotatable bonds 2
PSA 115.67
RO5 violations 0
RO3 violations 2
Refractivity 56.3082
Atoms 26
Rings 2
Heavy atoms 15
Hydrogen atoms 11
Heteroatoms 7
N/O atoms 6
Inorganic atoms 0
Halogen atoms 0
Chiral centers 2
R/S chiral centers 2
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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