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MCULE-5094091118
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.
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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.
|
|
|---|---|---|---|---|
| 1 mg | 67 USD | 98 | 12 working days | Get Quote |
| 5 mg | 67 USD | 98 | 12 working days | Get Quote |
| 10 mg | 111 USD | 98 | 12 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-8845284036
- Component type: Main
-
1
MCULE-4467353796
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5094091118.sdf |
| SMILES | MCULE-5094091118.smiles |
| Standard InChI | MCULE-5094091118.inchi |
| InChIKey | MCULE-5094091118.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-872722554 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-870652133 | Glentham Life Sciences | Compounds typically in stock | 98 | As is | in stock |
| P-885534827 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-867453149 | A2B Chem | Predominantly Building Block on demand | N/A | Main component | by synthesis |
| P-524299114 | Key Organics | Building Blocks | 99 | Main component | 1 mg |
| P-895286563 | MedChemExpress | Building Blocks on demand | 95 | Main component | by synthesis |
| P-885534828 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component | by synthesis |
| P-867520224 | A2B Chem | Predominantly Building Block on demand | N/A | Main component as a main component | by synthesis |
| P-893640135 | eNovation Chemicals LLC | Building Block on demand | 95 | Main component as a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 461.512 |
| logP | 2.54458 |
| H-bond acceptors | 9 |
| H-bond donors | 2 |
| Rotatable bonds | 4 |
| PSA | 134.35 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 132.2457 |
| Atoms | 61 |
| Rings | 4 |
| Heavy atoms | 34 |
| Hydrogen atoms | 27 |
| Heteroatoms | 9 |
| N/O atoms | 9 |
| 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 |
