P-8785666
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Name | File |
---|---|
SDF | P-8785666.sdf |
SMILES | P-8785666.smiles |
Standard InChI | P-8785666.inchi |
InChIKey | P-8785666.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-8785666 | ChemDiv | Discovery Chemistry Library | 90 | unavailable |
Property | Value |
---|---|
Components | 1 |
Mass | 346.471 |
logP | 0.5833 |
H-bond acceptors | 7 |
H-bond donors | 0 |
Rotatable bonds | 5 |
PSA | 55.81 |
RO5 violations | 0 |
RO3 violations | 3 |
Refractivity | 113.8025 |
Atoms | 55 |
Rings | 3 |
Heavy atoms | 25 |
Hydrogen atoms | 30 |
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 | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |