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P-890240046
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- InChIKey:
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- InChI:
- Formula:
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| Name | File |
|---|---|
| SDF | P-890240046.sdf |
| SMILES | P-890240046.smiles |
| Standard InChI | P-890240046.inchi |
| InChIKey | P-890240046.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-890240046 | BLD pharm | In-stock building blocks | 98 | unavailable |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 648.778 |
| logP | 3.6149 |
| H-bond acceptors | 13 |
| H-bond donors | 1 |
| Rotatable bonds | 8 |
| PSA | 143.28 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 190.1012 |
| Atoms | 86 |
| Rings | 6 |
| Heavy atoms | 46 |
| Hydrogen atoms | 40 |
| Heteroatoms | 14 |
| N/O atoms | 13 |
| 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 |
