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MCULE-5050558054
Compound
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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 | 13 USD | 97 | 9 working days | Get Quote |
| 5 mg | 13 USD | 97 | 9 working days | Get Quote |
| 10 mg | 13 USD | 97 | 9 working days | Get Quote |
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MCULE-1201255426
- Component type: Main
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MCULE-1252828430
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-5050558054.sdf |
| SMILES | MCULE-5050558054.smiles |
| Standard InChI | MCULE-5050558054.inchi |
| InChIKey | MCULE-5050558054.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-597027269 | 95 | As is | unavailable |
| P-903011212 | 99 | As is | 2 g |
| P-1264056900 | 99 | As is | in stock |
| P-500415099 | 95 | As is | by synthesis |
| P-505576594 | 98 | As is | in stock |
| P-851280704 | 95 | As is | by synthesis |
| P-868603202 | 98 | As is | in stock |
| P-852463306 | 95 | As is | by synthesis |
| P-904073102 | 95 | As is | in stock |
| P-608271454 | 98 | As is | in stock |
| P-878642501 | 98 | As is | in stock |
| P-579715465 | N/A | As is | in stock |
| P-617402549 | 98 | As is | in stock |
| P-1264050893 | 95 | As a main component | in stock |
| P-893522859 | 90 | As a main component | 1.54984 kg |
| P-617048186 | 95 | As a main component | by resynthesis (? - ? days) |
| P-875896915 | 95 | As a main component | in stock |
| P-489184619 | 97 | As a main component | in stock |
| P-505575158 | 98 | As a main component | in stock |
| P-868594924 | 97 | As a main component | in stock |
| P-579478571 | 95 | As a main component | in stock |
| P-579478572 | 95 | As a main component | in stock |
| P-905338448 | 98 | As a main component | 1000 mg |
| P-579611485 | 98 | As a main component | in stock |
| P-852444583 | 95 | As a main component | by synthesis |
| P-896627298 | 95 | As a main component | by synthesis |
| P-854714374 | 95 | As a main component | in stock |
| P-579715479 | N/A | As a main component | in stock |
| P-579710652 | 98 | As a main component | in stock |
| P-893608572 | 90 | As an isomer | 9.375 g |
| P-489196272 | 97 | As an isomer | in stock |
| P-563428531 | 95 | As an isomer | 1000 mg |
| P-524163808 | 99 | As an isomer | 5 mg |
| P-852494751 | 95 | As an isomer | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 297.416 |
| logP | 5.0218 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 6 |
| PSA | 49.5 |
| RO5 violations | 1 |
| RO3 violations | 2 |
| Refractivity | 90.0267 |
| Atoms | 40 |
| Rings | 3 |
| Heavy atoms | 21 |
| Hydrogen atoms | 19 |
| Heteroatoms | 3 |
| N/O atoms | 2 |
| 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 | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
