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P-33431959

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Name File
SDF P-33431959.sdf
SMILES P-33431959.smiles
Standard InChI P-33431959.inchi
InChIKey P-33431959.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-33431959 TimTec ActiMol 3 Week 90 in stock
Property Value
Components 1
Mass 345.778
logP 3.2097
H-bond acceptors 6
H-bond donors 2
Rotatable bonds 7
PSA 79.79
RO5 violations 0
RO3 violations 5
Refractivity 93.2034
Atoms 40
Rings 2
Heavy atoms 24
Hydrogen atoms 16
Heteroatoms 7
N/O atoms 6
Inorganic atoms 0
Halogen atoms 1
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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