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MCULE-4829454459
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.
|
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 | 134 USD | 90 | 27 working days | Get Quote |
| 5 mg | 158 USD | 90 | 27 working days | Get Quote |
| 10 mg | 176 USD | 90 | 27 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4829454459.sdf |
| SMILES | MCULE-4829454459.smiles |
| Standard InChI | MCULE-4829454459.inchi |
| InChIKey | MCULE-4829454459.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867427105 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
| P-881617063 | AmBeed | On request | N/A | As is | by synthesis |
| P-889029824 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-862123161 | FluoroChem | General BB | N/A | As is | in stock |
| P-601054881 | Life Chemicals | Screening Compounds | 90 | As is | 339 mg |
| P-14059451 | Life Chemicals | Building Blocks | 95 | As is | 339 mg |
| P-852507796 | Matrix Scientific | All | N/A | As is | in stock |
| P-611438022 | Toronto Research | In stock | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 182.206 |
| logP | 1.6649 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 106.07 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 44.7764 |
| Atoms | 18 |
| Rings | 2 |
| Heavy atoms | 12 |
| Hydrogen atoms | 6 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| 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 |
