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MCULE-4580588476
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 | 180 USD | 95 | 22 working days | Get Quote |
| 5 mg | 180 USD | 95 | 22 working days | Get Quote |
| 10 mg | 180 USD | 95 | 22 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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MCULE-2640343584
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-4580588476.sdf |
| SMILES | MCULE-4580588476.smiles |
| Standard InChI | MCULE-4580588476.inchi |
| InChIKey | MCULE-4580588476.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-904591605 | 95 | As is | in stock |
| P-851496573 | N/A | As is | by synthesis |
| P-611024914 | 95 | As is | by synthesis |
| P-895565149 | 95 | As is | by synthesis |
| P-886638781 | 95 | As a main component | in stock |
| P-889938698 | N/A | As a main component | by synthesis |
| P-903185571 | 95 | As a main component | 500 mg |
| P-889826086 | 95 | As a main component | by synthesis |
| P-611417293 | 90 | As a main component | in stock |
| P-893789580 | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 208.304 |
| logP | 2.1454 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 42.74 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 62.2837 |
| Atoms | 35 |
| Rings | 2 |
| Heavy atoms | 15 |
| 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 |
