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P-870661174
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| Name | File |
|---|---|
| SDF | P-870661174.sdf |
| SMILES | P-870661174.smiles |
| Standard InChI | P-870661174.inchi |
| InChIKey | P-870661174.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-870661174 | Glentham Life Sciences | Compounds typically in stock | N/A | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 679.784 |
| logP | 2.8705 |
| H-bond acceptors | 13 |
| H-bond donors | 4 |
| Rotatable bonds | 5 |
| PSA | 180.96 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 187.481 |
| Atoms | 89 |
| Rings | 8 |
| Heavy atoms | 48 |
| Hydrogen atoms | 41 |
| Heteroatoms | 14 |
| N/O atoms | 13 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 7 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 7 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
