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MCULE-6739922044
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 | 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-6739922044.sdf |
| SMILES | MCULE-6739922044.smiles |
| Standard InChI | MCULE-6739922044.inchi |
| InChIKey | MCULE-6739922044.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-25955365 | AnalytiCon Discovery | Natural screening compounds (85%+) | 85 | As is | 1 mg |
| P-500416255 | AvaChem Scientific | All products | 98 | As is | by synthesis |
| P-871221870 | BOC Sciences | All products | N/A | As is | by resynthesis (? - ? days) |
| P-505573097 | Bosche Scientific | Bosche Products | N/A | As is | in stock |
| P-452651168 | Chemfaces | Natural Compounds | 98 | As is | in stock |
| P-868595870 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
| P-579477897 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
| P-889110910 | FluoroChem | In Stock BB | N/A | As is | 583 g |
| P-854690810 | MedChemExpress | Natural Products In stock | 95 | As is | in stock |
| P-579710820 | Selleckchem | Product Catalog | N/A | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 414.619 |
| logP | 5.7139 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 38.69 |
| RO5 violations | 1 |
| RO3 violations | 2 |
| Refractivity | 121.5948 |
| Atoms | 72 |
| Rings | 6 |
| Heavy atoms | 30 |
| Hydrogen atoms | 42 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 11 |
| R/S chiral centers | 11 |
| 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 |
