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P-425455526
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- InChI:
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| Name | File |
|---|---|
| SDF | P-425455526.sdf |
| SMILES | P-425455526.smiles |
| Standard InChI | P-425455526.inchi |
| InChIKey | P-425455526.txt |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 394.359 |
| logP | 1.8366 |
| H-bond acceptors | 9 |
| H-bond donors | 1 |
| Rotatable bonds | 6 |
| PSA | 103.93 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 102.4657 |
| Atoms | 44 |
| Rings | 4 |
| Heavy atoms | 29 |
| Hydrogen atoms | 15 |
| Heteroatoms | 10 |
| N/O atoms | 9 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
