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MCULE-1862736447-1
Structure
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- InChIKey:
- 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.
|
|
|---|---|---|---|---|
| 1 mg | 6 USD | 99 | 9 working days | Get Quote |
| 5 mg | 6 USD | 99 | 9 working days | Get Quote |
| 10 mg | 6 USD | 99 | 9 working days | Get Quote |
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MCULE-9740144654-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1862736447-1.sdf |
| SMILES | MCULE-1862736447-1.smiles |
| Standard InChI | MCULE-1862736447-1.inchi |
| InChIKey | MCULE-1862736447-1.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-494343442 | Apollo Scientific | On request | 95 | As a main component | by resynthesis (? - ? days) |
| P-580699456 | BLD pharm | In-stock building blocks | 99 | As a main component | 340 g |
| P-868608514 | Combi-Blocks | Building Block in stock | 95 | As a main component | in stock |
| P-615655577 | LabNetwork | In stock | 95 | As a main component | in stock |
| P-874445162 | MedChemExpress | Screening compounds In stock | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 238.290 |
| logP | -2.0772 |
| H-bond acceptors | 6 |
| H-bond donors | 2 |
| Rotatable bonds | 7 |
| PSA | 182.9 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 51.2118 |
| Atoms | 24 |
| Rings | 0 |
| Heavy atoms | 14 |
| Hydrogen atoms | 10 |
| Heteroatoms | 8 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 2 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
