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MCULE-5422204120-1
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 | 68 USD | 90 | 10 working days | Get Quote |
| 5 mg | 84 USD | 90 | 10 working days | Get Quote |
| 10 mg | 115 USD | 90 | 10 working days | Get Quote |
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1
MCULE-3392939728-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5422204120-1.sdf |
| SMILES | MCULE-5422204120-1.smiles |
| Standard InChI | MCULE-5422204120-1.inchi |
| InChIKey | MCULE-5422204120-1.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-892997304 | A2B Chem | Predominantly Building Block on demand | N/A | Main component | by synthesis |
| P-893266068 | Biosynth | Synthesis | 95 | Main component | by synthesis |
| P-4480776 | ChemBridge | EXPRESS-Pick Collection | 90 | Main component | 11 mg |
| P-502874191 | Innovapharm | Screening Compounds | 90 | Main component | in stock |
| P-503071331 | Innovapharm | Virtual Screening Compounds | 90 | Main component | by synthesis |
| P-454310283 | Key Organics | Screening Compounds and Fragments | 90 | Main component | 95 mg |
| P-863973798 | MedChemExpress | Building Blocks on demand | 95 | Main component | by synthesis |
| P-631048606 | Otava | Tangible screening compounds | 90 | Main component | by synthesis |
| P-19260981 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
| P-33958593 | TimTec | ActiMol 6 Week | 90 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 322.853 |
| logP | 3.3839 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 4 |
| PSA | 51.79 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 96.7015 |
| Atoms | 40 |
| Rings | 3 |
| Heavy atoms | 21 |
| Hydrogen atoms | 19 |
| Heteroatoms | 5 |
| N/O atoms | 3 |
| 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 | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
