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MCULE-2829389689
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 | 96 USD | 95 | 11 working days | Get Quote |
| 5 mg | 209 USD | 98 | 22 working days | Get Quote |
| 10 mg | 339 USD | 98 | 22 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-2829389689.sdf |
| SMILES | MCULE-2829389689.smiles |
| Standard InChI | MCULE-2829389689.inchi |
| InChIKey | MCULE-2829389689.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867680099 | A2B Chem | Predominantly Building Block in stock | 99 | As is | in stock |
| P-875859082 | AA Blocks | AA Blocks | N/A | As is | in stock |
| P-878259699 | AmBeed | In stock | N/A | As is | in stock |
| P-888827158 | Angene | Building Blocks in stock | 98 | As is | 2 g |
| P-887185563 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-579482393 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
| P-873249039 | Key Organics | Building Blocks | 97 | As is | 1 mg |
| P-854715402 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-875884255 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-888173170 | Molnova | On demand | 98 | As is | by synthesis |
| P-888629656 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
| P-869111859 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
| P-868529561 | eNovation Chemicals LLC | Building Blocks in stock | 99 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 477.598 |
| logP | 4.9171 |
| H-bond acceptors | 8 |
| H-bond donors | 2 |
| Rotatable bonds | 10 |
| PSA | 80.65 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 142.8304 |
| Atoms | 70 |
| Rings | 4 |
| Heavy atoms | 35 |
| Hydrogen atoms | 35 |
| Heteroatoms | 8 |
| N/O atoms | 8 |
| 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 |
