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MCULE-1038057082-0
Structure
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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 | 13 USD | 98 | 11 working days | Get Quote |
| 5 mg | 13 USD | 98 | 11 working days | Get Quote |
| 10 mg | 13 USD | 98 | 11 working days | Get Quote |
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1
MCULE-7761179555-0
- Component type: Main
-
1
MCULE-5646000632-0
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1038057082-0.sdf |
| SMILES | MCULE-1038057082-0.smiles |
| Standard InChI | MCULE-1038057082-0.inchi |
| InChIKey | MCULE-1038057082-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-864158198 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-868591051 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-855910344 | Key Organics | Building Blocks | 95 | As is | 20.121 g |
| P-856006050 | Key Organics | Screening Compounds and Fragments | 95 | As is | 20.121 g |
| P-854711601 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-878646457 | Molnova | Stock | 98 | As is | in stock |
| P-888634151 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
| P-869119205 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
| P-854974007 | Toronto Research | In stock | 90 | As is | in stock |
| P-869183707 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-505391870 | AK Scientific | Building Blocks | 98 | Main component | in stock |
| P-868594247 | Combi-Blocks | Building Block in stock | 95 | Main component | in stock |
| P-524165405 | Key Organics | Building Blocks | 98 | Main component | 100 mg |
| P-888634152 | TargetMol | Screening Compounds | 95 | Main component | by synthesis |
| P-869119206 | TargetMol | Screening Compounds - stock amount | 95 | Main component | in stock |
| P-611489893 | Toronto Research | In stock | 90 | Main component | in stock |
| P-611462103 | Toronto Research | In stock | 90 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 198.158 |
| logP | 0.7128 |
| H-bond acceptors | 6 |
| H-bond donors | 4 |
| Rotatable bonds | 4 |
| PSA | 113.67 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 45.1806 |
| Atoms | 27 |
| Rings | 0 |
| Heavy atoms | 12 |
| Hydrogen atoms | 15 |
| Heteroatoms | 7 |
| N/O atoms | 6 |
| 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 |
