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UNKNOWN STEREO
P-611415362
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- InChIKey:
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- InChI:
- Formula:
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| Name | File |
|---|---|
| SDF | P-611415362.sdf |
| SMILES | P-611415362.smiles |
| Standard InChI | P-611415362.inchi |
| InChIKey | P-611415362.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-611415362 | Toronto Research | In stock | 90 | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 1393.658 |
| logP | 3.9078 |
| H-bond acceptors | 33 |
| H-bond donors | 14 |
| Rotatable bonds | 52 |
| PSA | 552.86 |
| RO5 violations | 3 |
| RO3 violations | 6 |
| Refractivity | 367.1547 |
| Atoms | 198 |
| Rings | 4 |
| Heavy atoms | 98 |
| Hydrogen atoms | 100 |
| Heteroatoms | 34 |
| N/O atoms | 33 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 10 |
| R/S chiral centers | 10 |
| 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 |
