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P-584625056
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- InChI:
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| Name | File |
|---|---|
| SDF | P-584625056.sdf |
| SMILES | P-584625056.smiles |
| Standard InChI | P-584625056.inchi |
| InChIKey | P-584625056.txt |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 740.657 |
| logP | -2.892 |
| H-bond acceptors | 19 |
| H-bond donors | 11 |
| Rotatable bonds | 8 |
| PSA | 308.12 |
| RO5 violations | 3 |
| RO3 violations | 5 |
| Refractivity | 170.3162 |
| Atoms | 92 |
| Rings | 6 |
| Heavy atoms | 52 |
| Hydrogen atoms | 40 |
| Heteroatoms | 19 |
| N/O atoms | 19 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 15 |
| R/S chiral centers | 15 |
| 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 |
