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MCULE-4482868332
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.
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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 | 56 USD | 95 | 11 working days | Get Quote |
| 5 mg | 127 USD | 95 | 11 working days | Get Quote |
| 10 mg | 206 USD | 95 | 11 working days | Get Quote |
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MCULE-7984014416
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-4482868332.sdf |
| SMILES | MCULE-4482868332.smiles |
| Standard InChI | MCULE-4482868332.inchi |
| InChIKey | MCULE-4482868332.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-869264771 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-489149366 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-873247148 | Key Organics | Building Blocks | 97 | As is | 1 mg |
| P-608218912 | Glentham Life Sciences | Compounds typically in stock | N/A | As a main component | in stock |
| P-596563403 | Key Organics | Building Blocks | 97 | As a main component | 10 mg |
| P-888657034 | TargetMol | Screening Compounds | 95 | As a main component | by synthesis |
| P-594274933 | TargetMol | Screening Compounds - stock amount | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 424.912 |
| logP | 3.195 |
| H-bond acceptors | 6 |
| H-bond donors | 4 |
| Rotatable bonds | 11 |
| PSA | 107.22 |
| RO5 violations | 0 |
| RO3 violations | 6 |
| Refractivity | 112.2442 |
| Atoms | 58 |
| Rings | 2 |
| Heavy atoms | 29 |
| Hydrogen atoms | 29 |
| Heteroatoms | 7 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 5 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 5 |
| Stereo double bonds | 2 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 2 |
| Undefined stereo double bonds | 0 |
