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UNKNOWN STEREO
MCULE-5272607960-0
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 | 44 USD | 90 | 21 working days | Get Quote |
| 5 mg | 44 USD | 95 | 9 working days | Get Quote |
| 10 mg | 71 USD | 95 | 9 working days | Get Quote |
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1
MCULE-9711164583-1
- Component type: Main
-
1
MCULE-6304532422-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5272607960-0.sdf |
| SMILES | MCULE-5272607960-0.smiles |
| Standard InChI | MCULE-5272607960-0.inchi |
| InChIKey | MCULE-5272607960-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-893166409 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-867559616 | A2B Chem | Predominantly Building Block in stock | 98 | Main component | in stock |
| P-869186045 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-505352526 | AK Scientific | Building Blocks | 98 | Main component | in stock |
| P-867732325 | AmBeed | On request | N/A | Main component | by synthesis |
| P-596944779 | Angene | Building Blocks in stock | 98 | Main component | 5 g |
| P-893255648 | Biosynth | Synthesis | 95 | Main component | by synthesis |
| P-675214529 | Hangzhou Apichem | Building Blocks in stock | 95 | Main component | in stock |
| P-890851212 | Innovapharm | Screening Compounds | 90 | Main component | in stock |
| P-881187949 | Otava | In-House Stock Library | 90 | Main component | 450 mg |
| P-869120842 | TargetMol | Screening Compounds - synthesis | 95 | Main component | by synthesis |
| P-892289595 | TargetMol | In Stock BB | 95 | Main component | unavailable |
| P-888635586 | TargetMol | Screening Compounds - stock amount | 95 | Main component | 46 mg |
| P-886924563 | eNovation Chemicals LLC | Building Block on demand | 95 | Main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 554.676 |
| logP | 4.9264 |
| H-bond acceptors | 11 |
| H-bond donors | 4 |
| Rotatable bonds | 10 |
| PSA | 175.32 |
| RO5 violations | 2 |
| RO3 violations | 6 |
| Refractivity | 147.4858 |
| Atoms | 77 |
| Rings | 2 |
| Heavy atoms | 38 |
| Hydrogen atoms | 39 |
| Heteroatoms | 12 |
| N/O atoms | 10 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 2 |
| R/S chiral centers | 2 |
| 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 |
