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P-33839111

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Name File
SDF P-33839111.sdf
SMILES P-33839111.smiles
Standard InChI P-33839111.inchi
InChIKey P-33839111.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-33839111 TimTec ActiMol 6 Week 90 in stock
Property Value
Components 1
Mass 395.451
logP 3.5055
H-bond acceptors 7
H-bond donors 1
Rotatable bonds 9
PSA 80.23
RO5 violations 0
RO3 violations 5
Refractivity 114.8287
Atoms 54
Rings 3
Heavy atoms 29
Hydrogen atoms 25
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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