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P-872868384
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| Name | File |
|---|---|
| SDF | P-872868384.sdf |
| SMILES | P-872868384.smiles |
| Standard InChI | P-872868384.inchi |
| InChIKey | P-872868384.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-872868384 | Axon Medchem | Axon predominantly SC catalog | 99 | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 851.964 |
| logP | 8.0256 |
| H-bond acceptors | 14 |
| H-bond donors | 2 |
| Rotatable bonds | 13 |
| PSA | 154.91 |
| RO5 violations | 3 |
| RO3 violations | 5 |
| Refractivity | 242.0409 |
| Atoms | 108 |
| Rings | 8 |
| Heavy atoms | 61 |
| Hydrogen atoms | 47 |
| Heteroatoms | 17 |
| N/O atoms | 14 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
