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MCULE-5419453222
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 | 124 USD | 98 | 20 working days | Get Quote |
| 5 mg | 124 USD | 98 | 20 working days | Get Quote |
| 10 mg | 124 USD | 98 | 20 working days | Get Quote |
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1
MCULE-1662082148
- Component type: Main
-
2
MCULE-6572487779
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5419453222.sdf |
| SMILES | MCULE-5419453222.smiles |
| Standard InChI | MCULE-5419453222.inchi |
| InChIKey | MCULE-5419453222.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-852184812 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-869148533 | TargetMol | Screening Compounds - synthesis | 95 | Main component | by synthesis |
| P-888649778 | TargetMol | Screening Compounds - stock amount | 95 | Main component | in stock |
| P-867678360 | A2B Chem | Predominantly Building Block in stock | 99 | Main component as a main component | in stock |
| P-874623544 | AK Scientific | Building Blocks | 99 | Main component as a main component | in stock |
| P-878260730 | AmBeed | In stock | N/A | Main component as a main component | in stock |
| P-873299756 | Angene | Building Blocks in stock | 98 | Main component as a main component | 13.17 g |
| P-872725803 | Apexbio Technology | Bioactive Compound Library | 98 | Main component as a main component | in stock |
| P-889788611 | AstaTech | In Stock BBs | 95 | Main component as a main component | in stock |
| P-580450798 | CliniSciences S.A.S | All products | 98 | Main component as a main component | in stock |
| P-869127886 | TargetMol | Screening Compounds - synthesis | 95 | Main component as a main component | by synthesis |
| P-888640804 | TargetMol | Screening Compounds - stock amount | 95 | Main component as a main component | in stock |
| P-855052218 | Toronto Research | In stock | 90 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 640.762 |
| logP | 6.4472 |
| H-bond acceptors | 9 |
| H-bond donors | 2 |
| Rotatable bonds | 9 |
| PSA | 141.21 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 171.3856 |
| Atoms | 81 |
| Rings | 4 |
| Heavy atoms | 43 |
| Hydrogen atoms | 38 |
| Heteroatoms | 13 |
| N/O atoms | 9 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 | 1 |
| Undefined stereo double bonds | 0 |
