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MCULE-4608299527-0
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 | 195 USD | 90 | 12 working days | Get Quote |
| 5 mg | 195 USD | 90 | 12 working days | Get Quote |
| 10 mg | 195 USD | 90 | 12 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4608299527-0.sdf |
| SMILES | MCULE-4608299527-0.smiles |
| Standard InChI | MCULE-4608299527-0.inchi |
| InChIKey | MCULE-4608299527-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867466401 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-436468953 | Alinda | Building Blocks | 95 | As is | in stock |
| P-454630448 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-436442939 | Chemical Block | Building Blocks | 90 | As is | unavailable |
| P-852448484 | Matrix Scientific | All | N/A | As is | in stock |
| P-895595086 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-502328329 | TimTec | Building Block Collection | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 349.257 |
| logP | 4.9152 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 117.58 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 84.9909 |
| Atoms | 30 |
| Rings | 2 |
| Heavy atoms | 20 |
| Hydrogen atoms | 10 |
| Heteroatoms | 8 |
| N/O atoms | 4 |
| 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 | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
