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MCULE-8051984649-0
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.
|
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 | 442 USD | 97 | 24 working days | Get Quote |
| 5 mg | 442 USD | 97 | 24 working days | Get Quote |
| 10 mg | 442 USD | 97 | 24 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-8051984649-0.sdf |
| SMILES | MCULE-8051984649-0.smiles |
| Standard InChI | MCULE-8051984649-0.inchi |
| InChIKey | MCULE-8051984649-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867457863 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-894669941 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-893385537 | Advanced ChemBlocks Inc (AChemBlock) | On demand | 90 | As is | by synthesis |
| P-851871244 | AmBeed | On request | N/A | As is | by synthesis |
| P-591049755 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
| P-577180449 | ChemDiv | Building Blocks on demand | 90 | As is | by synthesis |
| P-854953784 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-611611152 | Toronto Research | In stock | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 229.317 |
| logP | 3.8403 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 32.86 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 72.7292 |
| Atoms | 36 |
| Rings | 2 |
| Heavy atoms | 17 |
| Hydrogen atoms | 19 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 |
