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MCULE-8235161149-0
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.
|
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 | 46 USD | 90 | 21 working days | Get Quote |
| 5 mg | 74 USD | 90 | 21 working days | Get Quote |
| 10 mg | 88 USD | 90 | 21 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-8235161149-0.sdf |
| SMILES | MCULE-8235161149-0.smiles |
| Standard InChI | MCULE-8235161149-0.inchi |
| InChIKey | MCULE-8235161149-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-893021317 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-894647447 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-867728317 | AmBeed | On request | N/A | As is | by synthesis |
| P-611041682 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
| P-577180519 | ChemDiv | Building Blocks on demand | 90 | As is | by synthesis |
| P-502927281 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-863998320 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-12669668 | Otava | In-House Stock Library | 90 | As is | 50 mg |
| P-19673302 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-855220866 | Toronto Research | In stock | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 248.277 |
| logP | 1.7042 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 5 |
| PSA | 67.43 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 71.2774 |
| Atoms | 34 |
| Rings | 2 |
| Heavy atoms | 18 |
| Hydrogen atoms | 16 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| 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 |
