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MCULE-5985383882-0
Structure
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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 | 74 USD | 95 | 12 working days | Get Quote |
| 5 mg | 86 USD | 95 | 12 working days | Get Quote |
| 10 mg | 106 USD | 95 | 12 working days | Get Quote |
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1
MCULE-4320599724-0
- Component type: Main
-
1
MCULE-8917344355-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5985383882-0.sdf |
| SMILES | MCULE-5985383882-0.smiles |
| Standard InChI | MCULE-5985383882-0.inchi |
| InChIKey | MCULE-5985383882-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-890845581 | 95 | As is | in stock |
| P-890843667 | 95 | Main component as a main component | in stock |
| P-890845572 | 95 | Main component as a main component | in stock |
| P-890845575 | 95 | Main component as a main component | in stock |
| P-890845584 | 95 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 546.485 |
| logP | 10.1742 |
| H-bond acceptors | 7 |
| H-bond donors | 0 |
| Rotatable bonds | 3 |
| PSA | 160.52 |
| RO5 violations | 2 |
| RO3 violations | 4 |
| Refractivity | 161.1905 |
| Atoms | 59 |
| Rings | 7 |
| Heavy atoms | 41 |
| Hydrogen atoms | 18 |
| Heteroatoms | 11 |
| N/O atoms | 11 |
| 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 |
