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UNKNOWN STEREO
MCULE-3541925202-0
Structure
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- InChIKey:
- SMILES:
- InChI:
- Formula:
| Amount | Price
 Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.
|
Guaranteed purity (%) | Delivery time
Estimated door-to-door delivery time for EU and US customers. It will be refined and optimized during quote generation after the shipping country is specified.
|
|
|---|---|---|---|---|
| 1 mg | 16 USD | 95 | 18 working days | Get Quote |
| 5 mg | 16 USD | 95 | 18 working days | Get Quote |
| 10 mg | 16 USD | 95 | 18 working days | Get Quote |
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MCULE-3776434274-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-3541925202-0.sdf |
| SMILES | MCULE-3541925202-0.smiles |
| Standard InChI | MCULE-3541925202-0.inchi |
| InChIKey | MCULE-3541925202-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867542988 | 99 | As is | in stock |
| P-875699147 | 99 | As is | in stock |
| P-590372854 | 95 | As is | by resynthesis (? - ? days) |
| P-851906923 | N/A | As is | by synthesis |
| P-896045964 | 95 | As is | by synthesis |
| P-611435517 | 90 | As is | in stock |
| P-875719971 | 95 | As a main component | in stock |
| P-1275150339 | 95 | As a main component | in stock |
| P-1275198005 | 98 | As a main component | in stock |
| P-871256805 | N/A | As a main component | by synthesis |
| P-889477794 | 95 | As a main component | by synthesis |
| P-855090146 | 90 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 462.521 |
| logP | 4.3107 |
| H-bond acceptors | 10 |
| H-bond donors | 5 |
| Rotatable bonds | 14 |
| PSA | 166.06 |
| RO5 violations | 0 |
| RO3 violations | 6 |
| Refractivity | 118.0796 |
| Atoms | 58 |
| Rings | 2 |
| Heavy atoms | 32 |
| Hydrogen atoms | 26 |
| Heteroatoms | 11 |
| N/O atoms | 10 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
