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MCULE-6828775581
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.
|
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 | 78 USD | 98 | 16 working days | Get Quote |
| 5 mg | 78 USD | 98 | 16 working days | Get Quote |
| 10 mg | 78 USD | 98 | 16 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-6828775581.sdf |
| SMILES | MCULE-6828775581.smiles |
| Standard InChI | MCULE-6828775581.inchi |
| InChIKey | MCULE-6828775581.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867685290 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875862220 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869354083 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-584545538 | ChemDiv | Discovery Chemistry Library | 90 | As is | 1 mg |
| P-64826 | Chemical Block | Screening Library | 90 | As is | unavailable |
| P-642371585 | Otava | Tangible screening compounds | 90 | As is | by synthesis |
| P-22454795 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 88 mg |
| P-868528095 | eNovation Chemicals LLC | Building Blocks in stock | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 200.278 |
| logP | 1.6008 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 9 |
| PSA | 58.2 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 56.1874 |
| Atoms | 34 |
| Rings | 0 |
| Heavy atoms | 14 |
| Hydrogen atoms | 20 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
