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MCULE-9915974586
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.
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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 | 80 USD | 95 | 22 working days | Get Quote |
| 5 mg | 80 USD | 95 | 22 working days | Get Quote |
| 10 mg | 80 USD | 95 | 22 working days | Get Quote |
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MCULE-4784645610
- Component type: Main
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MCULE-2693012531
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-9915974586.sdf |
| SMILES | MCULE-9915974586.smiles |
| Standard InChI | MCULE-9915974586.inchi |
| InChIKey | MCULE-9915974586.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867493888 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-869482733 | Asinex | General screening catalog | 90 | As is | unavailable |
| P-666742919 | Specs | Screening Compounds | 90 | As is | 12 mg |
| P-867670529 | A2B Chem | Predominantly Building Block in stock | 95 | As a main component | in stock |
| P-875844483 | AA Blocks | AA Blocks - in stock | N/A | As a main component | in stock |
| P-851820231 | AmBeed | On request | N/A | As a main component | by synthesis |
| P-611190386 | BLD pharm | Non-stock building blocks | 97 | As a main component | by synthesis |
| P-674261323 | ChemDiv | Discovery Chemistry Library | 90 | As a main component | 6 mg |
| P-861374774 | Combi-Blocks | Building Block on demand | 95 | As a main component | by synthesis |
| P-34792083 | Crea-Chim | HTS compounds | 90 | As a main component | by resynthesis (? - ? days) |
| P-862059597 | FluoroChem | General BB | N/A | As a main component | in stock |
| P-893679092 | eNovation Chemicals LLC | Building Block on demand | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 267.365 |
| logP | 4.2533 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 21.26 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 82.4617 |
| Atoms | 41 |
| Rings | 3 |
| Heavy atoms | 20 |
| Hydrogen atoms | 21 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
