P-893165730
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Name | File |
---|---|
SDF | P-893165730.sdf |
SMILES | P-893165730.smiles |
Standard InChI | P-893165730.inchi |
InChIKey | P-893165730.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-893165730 | A2B Chem | Predominantly Building Block on demand | N/A | by synthesis |
Property | Value |
---|---|
Components | 2 |
Mass | 288.409 |
logP | 4.1873 |
H-bond acceptors | 5 |
H-bond donors | 3 |
Rotatable bonds | 6 |
PSA | 114.79 |
RO5 violations | 0 |
RO3 violations | 4 |
Refractivity | 77.6376 |
Atoms | 43 |
Rings | 1 |
Heavy atoms | 19 |
Hydrogen atoms | 24 |
Heteroatoms | 6 |
N/O atoms | 5 |
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 |