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P-502367901

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Name File
SDF P-502367901.sdf
SMILES P-502367901.smiles
Standard InChI P-502367901.inchi
InChIKey P-502367901.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-502367901 TimTec Building Block Collection 90 in stock
Property Value
Components 2
Mass 136.111
logP -2.295
H-bond acceptors 7
H-bond donors 5
Rotatable bonds 1
PSA 149.9
RO5 violations 0
RO3 violations 3
Refractivity 28.6972
Atoms 17
Rings 0
Heavy atoms 9
Hydrogen atoms 8
Heteroatoms 7
N/O atoms 7
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 1
Cis/trans stereo double bonds 0
Unknown stereo double bonds 1
Undefined stereo double bonds 0
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