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MCULE-3004895223
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 | 5 USD | 97 | 16 working days | Get Quote |
| 5 mg | 5 USD | 97 | 16 working days | Get Quote |
| 10 mg | 5 USD | 97 | 16 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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1
MCULE-4990406871
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-3004895223.sdf |
| SMILES | MCULE-3004895223.smiles |
| Standard InChI | MCULE-3004895223.inchi |
| InChIKey | MCULE-3004895223.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-33411142 | TimTec | ActiMol 2 Week | 90 | As is | in stock |
| P-886574479 | A2B Chem | Predominantly Building Block in stock | 97 | Main component | in stock |
| P-885952240 | A2B Chem | Predominantly Building Block on demand | 95 | Main component | by synthesis |
| P-590394391 | AK Scientific | Building Blocks | 98 | Main component | in stock |
| P-881674421 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-606858658 | AmBeed | In stock | N/A | Main component | in stock |
| P-864139330 | AstaTech | In Stock BBs | 95 | Main component | in stock |
| P-851277215 | Chemshuttle | On request catalog | 95 | Main component | by synthesis |
| P-888314172 | Frontier Specialty Chemicals Inc | All products | N/A | Main component | in stock |
| P-888313585 | Frontier Specialty Chemicals Inc | All products | N/A | Main component | in stock |
| P-519366143 | InterBioScreen | Screening Compounds | 92 | Main component | 15 mg |
| P-454417248 | Key Organics | Building Blocks | 95 | Main component | 10 g |
| P-31175274 | LaboTest | Screening Collection | 90 | Main component | unavailable |
| P-856045937 | LaboTest | Building Blocks | 90 | Main component | unavailable |
| P-888726715 | Manchester Organics | Stock compounds | N/A | Main component | 5 g |
| P-579723643 | Menai Organics | Building blocks | 90 | Main component | in stock |
| P-888164219 | Menai Organics | Screening compounds | 90 | Main component | in stock |
| P-617681046 | Otava | In-House Stock Library | 90 | Main component | 92 mg |
| P-13447825 | Pharmeks LLC | Synthetic compounds | 92 | Main component | in stock |
| P-520072623 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
| P-502333062 | TimTec | Building Block Collection | 90 | Main component | in stock |
| P-1724055 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | Main component | 68 mg |
| P-666966318 | eNovation Chemicals LLC | Building Blocks in stock | 97 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 651.193 |
| logP | 7.6682 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 4 |
| PSA | 56.3 |
| RO5 violations | 2 |
| RO3 violations | 4 |
| Refractivity | 210.4344 |
| Atoms | 80 |
| Rings | 9 |
| Heavy atoms | 49 |
| Hydrogen atoms | 31 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 8 |
| Cis/trans stereo double bonds | 4 |
| Unknown stereo double bonds | 4 |
| Undefined stereo double bonds | 0 |
