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MCULE-7591789121-0
Structure
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- SMILES:
- InChI:
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| Amount | Price
 Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.
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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.
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|---|---|---|---|---|
| 1 mg | 23 USD | N/A | 9 working days | Get Quote |
| 5 mg | 23 USD | N/A | 9 working days | Get Quote |
| 10 mg | 23 USD | N/A | 9 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-3588338775-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-7591789121-0.sdf |
| SMILES | MCULE-7591789121-0.smiles |
| Standard InChI | MCULE-7591789121-0.inchi |
| InChIKey | MCULE-7591789121-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-617744123 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 129 mg |
| P-851889878 | AmBeed | On request | N/A | Main component | by synthesis |
| P-596511524 | Asinex | General bb catalog | 90 | Main component | unavailable |
| P-591180583 | BLD pharm | Non-stock building blocks | 95 | Main component | by synthesis |
| P-580284669 | Debye Scientific | General Catalog | N/A | Main component | by resynthesis (? - ? days) |
| P-895688755 | MedChemExpress | Building Blocks on demand | 95 | Main component | by synthesis |
| P-454023065 | Specs | Screening Compounds | 90 | Main component | 27 mg |
| P-855216362 | Toronto Research | In stock | 90 | Main component | in stock |
| P-867670530 | A2B Chem | Predominantly Building Block in stock | 95 | Main component as a main component | in stock |
| P-875844484 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-892495907 | Asinex | General screening catalog | 90 | Main component as a main component | 1000 mg |
| P-611112391 | BLD pharm | Non-stock building blocks | 95 | Main component as a main component | by synthesis |
| P-674226379 | ChemDiv | Discovery Chemistry Library | 90 | Main component as a main component | 54 mg |
| P-861375100 | Combi-Blocks | Building Block on demand | N/A | Main component as a main component | by synthesis |
| P-34795614 | Crea-Chim | HTS compounds | 90 | Main component as a main component | in stock |
| P-855951945 | Key Organics | Building Blocks | 95 | Main component as a main component | 1000 mg |
| P-852383532 | Matrix Scientific | All | N/A | Main component as a main component | in stock |
| P-873216724 | TimTec | Building Block Collection | 90 | Main component as a main component | in stock |
| P-903637734 | TimTec | ActiMol 4 Week - On demand | 94 | Main component as a main component | by resynthesis (? - ? days) |
| P-893682159 | eNovation Chemicals LLC | Building Block on demand | 95 | Main component as a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 275.770 |
| logP | 3.0212 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 7 |
| PSA | 39.72 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 74.4717 |
| Atoms | 40 |
| Rings | 1 |
| Heavy atoms | 18 |
| Hydrogen atoms | 22 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
