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MCULE-9989504957
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 | 261 USD | 98 | 19 working days | Get Quote |
| 5 mg | 261 USD | 98 | 19 working days | Get Quote |
| 10 mg | 441 USD | 98 | 19 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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1
MCULE-7660256989
- Component type: Main
-
1
MCULE-3833394421
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-9989504957.sdf |
| SMILES | MCULE-9989504957.smiles |
| Standard InChI | MCULE-9989504957.inchi |
| InChIKey | MCULE-9989504957.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-505401458 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-524166863 | Key Organics | Building Blocks | 95 | As is | 5 mg |
| P-852520848 | Matrix Scientific | All | N/A | As is | in stock |
| P-853425186 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-851533792 | AmBeed | On request | N/A | Main component | by synthesis |
| P-590792698 | BLD pharm | Non-stock building blocks | 95 | Main component | by synthesis |
| P-580291615 | Debye Scientific | General Catalog | N/A | Main component | by resynthesis (? - ? days) |
| P-889281431 | FluoroChem | General BB | 95 | Main component | in stock |
| P-852464371 | Matrix Scientific | All | N/A | Main component | in stock |
| P-863857076 | MedChemExpress | Building Blocks on demand | 95 | Main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 362.316 |
| logP | 2.3394 |
| H-bond acceptors | 6 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 90.83 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 97.3347 |
| Atoms | 38 |
| Rings | 4 |
| Heavy atoms | 27 |
| Hydrogen atoms | 11 |
| Heteroatoms | 7 |
| N/O atoms | 6 |
| Inorganic atoms | 1 |
| Halogen atoms | 0 |
| 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 |
