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MCULE-4905485828
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 | 167 USD | 95 | 14 working days | Get Quote |
| 5 mg | 561 USD | 10 | 20 working days | Get Quote |
| 10 mg | 801 USD | 10 | 20 working days | Get Quote |
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MCULE-9992817708
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-4905485828.sdf |
| SMILES | MCULE-4905485828.smiles |
| Standard InChI | MCULE-4905485828.inchi |
| InChIKey | MCULE-4905485828.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-893108049 | N/A | As a main component | by synthesis |
| P-867533705 | 95 | As a main component | in stock |
| P-875688619 | N/A | As a main component | in stock |
| P-869263911 | 95 | As a main component | in stock |
| P-903007692 | 98 | As a main component | 200 mg |
| P-904320737 | 90 | As a main component | 1.259 g |
| P-891647551 | N/A | As a main component | by synthesis |
| P-895092851 | 10 | As a main component | 200 mg |
| P-889520533 | 95 | As a main component | by synthesis |
| P-905523584 | 98 | As a main component | by synthesis |
| P-893225442 | 95 | As a main component | in stock |
| P-895180963 | 95 | As a main component | in stock |
| P-611505231 | 90 | As a main component | in stock |
| P-893881698 | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 606.856 |
| logP | 7.8727 |
| H-bond acceptors | 9 |
| H-bond donors | 1 |
| Rotatable bonds | 30 |
| PSA | 98.05 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 175.1187 |
| Atoms | 103 |
| Rings | 1 |
| Heavy atoms | 43 |
| Hydrogen atoms | 60 |
| Heteroatoms | 9 |
| N/O atoms | 9 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
