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MCULE-4541061051
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.
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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 | 166 USD | 95 | 14 working days | Get Quote |
| 5 mg | 325 USD | 98 | 22 working days | Get Quote |
| 10 mg | 468 USD | 95 | 10 working days | Get Quote |
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MCULE-1168597714
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-4541061051.sdf |
| SMILES | MCULE-4541061051.smiles |
| Standard InChI | MCULE-4541061051.inchi |
| InChIKey | MCULE-4541061051.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-617430540 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
| P-868361699 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868659497 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
| P-854713856 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-871071925 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-888170633 | Molnova | On demand | 98 | As is | by synthesis |
| P-861286644 | Chiralstar | Chiralstar Building Blocks | 98 | As an isomer | in stock |
| P-873247269 | Key Organics | Building Blocks | 97 | As an isomer | 5 mg |
| P-873247270 | Key Organics | Building Blocks | 97 | As an isomer | 5 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 428.306 |
| logP | 3.7137 |
| H-bond acceptors | 7 |
| H-bond donors | 3 |
| Rotatable bonds | 10 |
| PSA | 104.45 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 107.7633 |
| Atoms | 51 |
| Rings | 2 |
| Heavy atoms | 28 |
| Hydrogen atoms | 23 |
| Heteroatoms | 9 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
