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MCULE-5535008514-0
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.
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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 | 33 USD | 90 | 19 working days | Get Quote |
| 5 mg | 35 USD | 90 | 17 working days | Get Quote |
| 10 mg | 41 USD | 90 | 17 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-3161062012-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5535008514-0.sdf |
| SMILES | MCULE-5535008514-0.smiles |
| Standard InChI | MCULE-5535008514-0.inchi |
| InChIKey | MCULE-5535008514-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-4313501 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 50 mg |
| P-867623750 | A2B Chem | Predominantly Building Block in stock | 95 | Main component | in stock |
| P-590419161 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-517095238 | Alinda | Stock Screening Compounds | 90 | Main component | in stock |
| P-851744346 | AmBeed | On request | N/A | Main component | by synthesis |
| P-3347055 | ChemDiv | Discovery Chemistry Library | 90 | Main component | 37 mg |
| P-502595858 | Innovapharm | Screening Compounds | 90 | Main component | in stock |
| P-502808227 | Innovapharm | Screening Compounds | 90 | Main component | in stock |
| P-503136886 | Innovapharm | Virtual Screening Compounds | 90 | Main component | by synthesis |
| P-12493397 | InterBioScreen | Screening Compounds | 92 | Main component | 300 mg |
| P-454380599 | Key Organics | Building Blocks | 95 | Main component | 37.288 g |
| P-18717851 | Key Organics | Screening Compounds and Fragments | 95 | Main component | 37.288 g |
| P-35166574 | Maybridge | Screening Collection | 90 | Main component | 18.122 kg |
| P-12958812 | Otava | In-House Stock Library | 90 | Main component | 50 mg |
| P-18834854 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
| P-502326862 | TimTec | Building Block Collection | 90 | Main component | in stock |
| P-22442884 | TimTec | ActiMol 1 Week - Stock | 90 | Main component | 1000 mg |
| P-1848163 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | Main component | 214 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 258.772 |
| logP | 2.8129 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 4 |
| PSA | 85.74 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 74.3721 |
| Atoms | 31 |
| Rings | 1 |
| Heavy atoms | 16 |
| Hydrogen atoms | 15 |
| Heteroatoms | 6 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| 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 |
