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UNKNOWN STEREO
MCULE-5125911600-0
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 | 6 USD | N/A | 9 working days | Get Quote |
| 5 mg | 6 USD | N/A | 9 working days | Get Quote |
| 10 mg | 6 USD | N/A | 9 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-6838831738-0
- Component type: Main
-
1
MCULE-3169739755-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5125911600-0.sdf |
| SMILES | MCULE-5125911600-0.smiles |
| Standard InChI | MCULE-5125911600-0.inchi |
| InChIKey | MCULE-5125911600-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867482718 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-611353722 | Toronto Research | In stock | 90 | As is | in stock |
| P-886968235 | eNovation Chemicals LLC | Building Block on demand | 95 | Main component | by synthesis |
| P-867568464 | A2B Chem | Predominantly Building Block in stock | 95 | Main component as a main component | in stock |
| P-875728692 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-535626681 | AK Scientific | Building Blocks | 95 | Main component as a main component | in stock |
| P-869183713 | AK Scientific | Building Blocks | 95 | Main component as a main component | in stock |
| P-588246274 | AK Scientific | Building Blocks | 98 | Main component as a main component | in stock |
| P-505395275 | AK Scientific | Building Blocks | 98 | Main component as a main component | in stock |
| P-492323101 | Advamacs (TriMen Chemicals) | Predominantly Building Blocks in stock | 95 | Main component as a main component | in stock |
| P-893338052 | Aldlab Chemicals | Building Block Custom Synth | 95 | Main component as a main component | by synthesis |
| P-580239854 | Aldlab Chemicals | Building Block Custom Synth | 95 | Main component as a main component | by synthesis |
| P-606908523 | AmBeed | In stock | N/A | Main component as a main component | in stock |
| P-606877814 | AmBeed | In stock | N/A | Main component as a main component | in stock |
| P-596948554 | Angene | Building Blocks in stock | 98 | Main component as a main component | 3.5 kg |
| P-864114917 | AstaTech | In Stock BBs | 95 | Main component as a main component | in stock |
| P-864114915 | AstaTech | In Stock BBs | 97 | Main component as a main component | in stock |
| P-893250354 | Biosynth | Synthesis | 95 | Main component as a main component | by synthesis |
| P-428630750 | Eximed | In-stock screening compounds | 90 | Main component as a main component | 5.52 g |
| P-505495873 | Hangzhou Apichem | Building Blocks in stock | 95 | Main component as a main component | in stock |
| P-580041968 | Innovapharm | Screening Compounds | 90 | Main component as a main component | in stock |
| P-580005869 | Innovapharm | Building Blocks | 95 | Main component as a main component | in stock |
| P-35205996 | Maybridge | Screening Collection | 90 | Main component as a main component | 3.416 kg |
| P-881184002 | Otava | In-House Stock Library | 90 | Main component as a main component | 5.52 g |
| P-500410378 | Pi Chemicals | Virtual Compounds | 98 | Main component as a main component | by synthesis |
| P-500378684 | Pi Chemicals | Virtual Compounds | 98 | Main component as a main component | by synthesis |
| P-500387697 | Pi Chemicals | Virtual Compounds | 98 | Main component as a main component | by synthesis |
| P-892261275 | TargetMol | Screening Compounds - synthesis | 95 | Main component as a main component | by synthesis |
| P-892342714 | TargetMol | Screening Compounds - stock amount | 95 | Main component as a main component | unavailable |
| P-873222565 | TimTec | Building Block Collection | 90 | Main component as a main component | in stock |
| P-611353725 | Toronto Research | In stock | 90 | Main component as a main component | in stock |
| P-854977803 | Toronto Research | In stock | 90 | Main component as a main component | in stock |
| P-855082737 | Toronto Research | In stock | 90 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 337.392 |
| logP | 3.7914 |
| H-bond acceptors | 6 |
| H-bond donors | 2 |
| Rotatable bonds | 5 |
| PSA | 115.07 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 86.1222 |
| Atoms | 42 |
| Rings | 2 |
| Heavy atoms | 23 |
| Hydrogen atoms | 19 |
| Heteroatoms | 7 |
| N/O atoms | 6 |
| 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 |
