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MCULE-4622251146-1
Structure
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- 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 | 16 USD | 95 | 18 working days | Get Quote |
| 5 mg | 16 USD | 95 | 18 working days | Get Quote |
| 10 mg | 16 USD | 95 | 18 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4622251146-1.sdf |
| SMILES | MCULE-4622251146-1.smiles |
| Standard InChI | MCULE-4622251146-1.inchi |
| InChIKey | MCULE-4622251146-1.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-869181476 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-869330033 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-588246767 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-851152306 | Angene | Building Blocks in stock | 98 | As is | 3.25 kg |
| P-596278465 | Asinex | General screening catalog | 90 | As is | unavailable |
| P-596486863 | Asinex | General bb catalog | 90 | As is | unavailable |
| P-893252176 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-619314237 | ChemDiv | Discovery Chemistry Library | 90 | As is | 5 mg |
| P-34591157 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
| P-580304249 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-870655227 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-492219899 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-596574853 | Key Organics | Building Blocks | 97 | As is | 50 g |
| P-856006786 | Key Organics | Screening Compounds and Fragments | 97 | As is | 100 mg |
| P-31156577 | LaboTest | Screening Collection | 90 | As is | 10 g |
| P-856043765 | LaboTest | Building Blocks | 90 | As is | 10 g |
| P-12682486 | Otava | In-House Stock Library | 90 | As is | 52 mg |
| P-500404068 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-22757416 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-615419087 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 214.608 |
| logP | -0.3863 |
| H-bond acceptors | 6 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 72.68 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 52.1477 |
| Atoms | 21 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 7 |
| Heteroatoms | 7 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
