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MCULE-5417007202-0
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.
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|---|---|---|---|---|
| 1 mg | 605 USD | 95 | 22 working days | Get Quote |
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MCULE-8635684538-1
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-5417007202-0.sdf |
| SMILES | MCULE-5417007202-0.smiles |
| Standard InChI | MCULE-5417007202-0.inchi |
| InChIKey | MCULE-5417007202-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867617380 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875778572 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-895097333 | Angene | Building Blocks in stock | N/A | As is | 1 mg |
| P-873247378 | Key Organics | Building Blocks | 97 | As is | 1 mg |
| P-863725676 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-854991466 | Toronto Research | In stock | 90 | As is | in stock |
| P-893969999 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-871071900 | MedKoo | In stock compounds | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 430.460 |
| logP | 5.95358 |
| H-bond acceptors | 7 |
| H-bond donors | 3 |
| Rotatable bonds | 6 |
| PSA | 106.49 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 128.1971 |
| Atoms | 51 |
| Rings | 5 |
| Heavy atoms | 33 |
| Hydrogen atoms | 18 |
| Heteroatoms | 7 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
