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MCULE-5497122448
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 | 118 USD | 95 | 37 working days | Get Quote |
| 5 mg | 155 USD | 95 | 14 working days | Get Quote |
| 10 mg | 203 USD | 97 | 22 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-5497122448.sdf |
| SMILES | MCULE-5497122448.smiles |
| Standard InChI | MCULE-5497122448.inchi |
| InChIKey | MCULE-5497122448.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867610112 | A2B Chem | Predominantly Building Block in stock | 99 | As is | in stock |
| P-875769594 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869314811 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-891659583 | AmBeed | On request | N/A | As is | by synthesis |
| P-895096165 | Angene | Building Blocks in stock | N/A | As is | 10 mg |
| P-889521808 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-870659833 | Glentham Life Sciences | Compounds typically in stock | 97 | As is | in stock |
| P-888623069 | Key Organics | Building Blocks | 95 | As is | 5 mg |
| P-873242485 | Key Organics | Building Blocks | 97 | As is | 5 mg |
| P-863737898 | MedChemExpress | Natural Products In stock | 95 | As is | in stock |
| P-594047052 | Otava | Virtual BB | 95 | As is | by synthesis |
| P-869124377 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-888638179 | TargetMol | Screening Compounds - stock amount | 95 | As is | unavailable |
| P-893721882 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 241.283 |
| logP | 1.3485 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 8 |
| PSA | 72.47 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 62.1707 |
| Atoms | 36 |
| Rings | 1 |
| Heavy atoms | 17 |
| Hydrogen atoms | 19 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
