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MCULE-6131708048-0
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 | 164 USD | 95 | 17 working days | Get Quote |
| 5 mg | 164 USD | 95 | 17 working days | Get Quote |
| 10 mg | 254 USD | 95 | 17 working days | Get Quote |
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2
MCULE-4599151265-0
- Component type: Main
-
1
MCULE-1504889908-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-6131708048-0.sdf |
| SMILES | MCULE-6131708048-0.smiles |
| Standard InChI | MCULE-6131708048-0.inchi |
| InChIKey | MCULE-6131708048-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-33369795 | 90 | As is | in stock |
| P-611419841 | 90 | As is | in stock |
| P-870662772 | 95 | Main component | in stock |
| P-855928678 | 95 | Main component | 1 mg |
| P-870659815 | N/A | Main component as a main component | in stock |
| P-870660309 | 90 | Main component as a main component | in stock |
| P-906793832 | 90 | Main component as a main component | by synthesis |
| P-894010001 | 95 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 951.189 |
| logP | 5.1854 |
| H-bond acceptors | 24 |
| H-bond donors | 14 |
| Rotatable bonds | 36 |
| PSA | 415.52 |
| RO5 violations | 4 |
| RO3 violations | 6 |
| Refractivity | 247.3394 |
| Atoms | 143 |
| Rings | 0 |
| Heavy atoms | 65 |
| Hydrogen atoms | 78 |
| Heteroatoms | 25 |
| N/O atoms | 24 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 3 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 3 |
| Stereo double bonds | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
