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MCULE-2006215712
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 | 396 USD | 95 | 38 working days | Get Quote |
| 5 mg | 396 USD | 95 | 38 working days | Get Quote |
| 10 mg | 396 USD | 95 | 38 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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2
MCULE-8487261994
- Component type: Main
-
1
MCULE-3743781291
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-2006215712.sdf |
| SMILES | MCULE-2006215712.smiles |
| Standard InChI | MCULE-2006215712.inchi |
| InChIKey | MCULE-2006215712.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-33409194 | TimTec | ActiMol 2 Week | 90 | As is | in stock |
| P-867442910 | A2B Chem | Predominantly Building Block on demand | N/A | Main component | by synthesis |
| P-874649457 | AK Scientific | Building Blocks | 97 | Main component | in stock |
| P-613333991 | Life Chemicals | Building Blocks - virtual | 95 | Main component | by synthesis |
| P-854906512 | MedChemExpress | Building Blocks on demand | 95 | Main component | by synthesis |
| P-855285684 | Toronto Research | In stock | 90 | Main component | in stock |
| P-893695083 | eNovation Chemicals LLC | Building Block on demand | 95 | Main component | by synthesis |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 388.464 |
| logP | 5.0772 |
| H-bond acceptors | 9 |
| H-bond donors | 8 |
| Rotatable bonds | 6 |
| PSA | 181.33 |
| RO5 violations | 2 |
| RO3 violations | 6 |
| Refractivity | 114.2912 |
| Atoms | 56 |
| Rings | 2 |
| Heavy atoms | 28 |
| Hydrogen atoms | 28 |
| Heteroatoms | 9 |
| N/O atoms | 9 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 1 |
