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MCULE-2852848721
Compound
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- 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 | 13 USD | 98 | 11 working days | Get Quote |
| 5 mg | 13 USD | 98 | 11 working days | Get Quote |
| 10 mg | 13 USD | 98 | 11 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-2852848721.sdf |
| SMILES | MCULE-2852848721.smiles |
| Standard InChI | MCULE-2852848721.inchi |
| InChIKey | MCULE-2852848721.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-489212948 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-25940079 | AnalytiCon Discovery | Natural screening compounds (70%+) | 70 | As is | 100 mg |
| P-866725663 | Apollo Scientific | In Stock | 95 | As is | in stock |
| P-500414863 | AvaChem Scientific | All products | 98 | As is | by synthesis |
| P-580699263 | BLD pharm | In-stock building blocks | 95 | As is | 100 g |
| P-452651513 | Chemfaces | Natural Compounds | 98 | As is | in stock |
| P-851308042 | Chemshuttle | On request catalog | 9 | As is | by synthesis |
| P-861449553 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-854692011 | MedChemExpress | Natural Products In stock | 95 | As is | in stock |
| P-474024228 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-619672745 | Molnova | Stock | 98 | As is | in stock |
| P-617402046 | Selleckchem | Product Catalog | N/A | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 464.375 |
| logP | -0.5389 |
| H-bond acceptors | 12 |
| H-bond donors | 8 |
| Rotatable bonds | 4 |
| PSA | 210.51 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 110.1572 |
| Atoms | 53 |
| Rings | 4 |
| Heavy atoms | 33 |
| Hydrogen atoms | 20 |
| Heteroatoms | 12 |
| N/O atoms | 12 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 5 |
| R/S chiral centers | 5 |
| 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 |
