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UNKNOWN STEREO
MCULE-4047466485-0
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 | 7 USD | 98 | 20 working days | Get Quote |
| 5 mg | 7 USD | 98 | 20 working days | Get Quote |
| 10 mg | 7 USD | 98 | 20 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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1
MCULE-6700641640-3
- Component type: Main
-
1
MCULE-5396813937-0
- Component type: Counter Ion
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-4047466485-0.sdf |
| SMILES | MCULE-4047466485-0.smiles |
| Standard InChI | MCULE-4047466485-0.inchi |
| InChIKey | MCULE-4047466485-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-611504224 | 90 | As is | in stock |
| P-611460671 | 90 | As is | in stock |
| P-875769739 | N/A | Main component as a main component | in stock |
| P-890165475 | N/A | Main component as a main component | in stock |
| P-894680636 | 95 | Main component as a main component | in stock |
| P-595218377 | 95 | Main component as a main component | in stock |
| P-851418755 | N/A | Main component as a main component | by synthesis |
| P-606917856 | N/A | Main component as a main component | in stock |
| P-888822298 | 98 | Main component as a main component | 4 kg |
| P-895096175 | 98 | Main component as a main component | 1000 mg |
| P-889519965 | 95 | Main component as a main component | by synthesis |
| P-864211031 | 95 | Main component as a main component | in stock |
| P-611494027 | 90 | Main component as a main component | in stock |
| P-611555317 | 90 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 207.624 |
| logP | -2.2941 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 106.28 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 30.6734 |
| Atoms | 17 |
| Rings | 0 |
| Heavy atoms | 11 |
| Hydrogen atoms | 6 |
| Heteroatoms | 7 |
| N/O atoms | 5 |
| Inorganic atoms | 1 |
| Halogen atoms | 1 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
