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MCULE-5696446774-0
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 | 50 USD | 90 | 19 working days | Get Quote |
| 10 mg | 63 USD | 90 | 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-2359164432-0
- Component type: Main
-
1
MCULE-4467353796-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5696446774-0.sdf |
| SMILES | MCULE-5696446774-0.smiles |
| Standard InChI | MCULE-5696446774-0.inchi |
| InChIKey | MCULE-5696446774-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-854184144 | InterBioScreen | Screening Compounds | 92 | As is | 245 mg |
| P-674928334 | Otava | In-House Stock Library | 90 | As is | 90 mg |
| P-893030009 | A2B Chem | Predominantly Building Block on demand | N/A | Main component | by synthesis |
| P-596417732 | Asinex | General screening catalog | 90 | Main component | 128 mg |
| P-653026299 | Otava | Tangible screening compounds | 90 | Main component | by synthesis |
| P-579250253 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
| P-33811691 | TimTec | ActiMol 6 Week | 90 | Main component | in stock |
| P-873080990 | TimTec | ActiMol 4 Week - On demand | 94 | Main component | by resynthesis (? - ? days) |
| P-852030599 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | Main component | 55 mg |
| P-886410491 | A2B Chem | Predominantly Building Block on demand | N/A | Main component as a main component | by synthesis |
| P-4391538 | ChemBridge | EXPRESS-Pick Collection | 90 | Main component as a main component | 25 mg |
| P-619315758 | ChemDiv | Discovery Chemistry Library | 90 | Main component as a main component | 9 mg |
| P-675337906 | Innovapharm | Screening Compounds | 90 | Main component as a main component | in stock |
| P-25738725 | Life Chemicals | Screening Compounds | 90 | Main component as a main component | 748 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 411.533 |
| logP | 4.2094 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 8 |
| PSA | 70.0 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 124.7561 |
| Atoms | 63 |
| Rings | 3 |
| Heavy atoms | 30 |
| Hydrogen atoms | 33 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| 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 |
