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MCULE-5706924248-0
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 | 338 USD | 97 | 27 working days | Get Quote |
| 5 mg | 338 USD | 97 | 27 working days | Get Quote |
| 10 mg | 338 USD | 97 | 27 working days | Get Quote |
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1
MCULE-5802470514-1
- Component type: Main
-
1
MCULE-3833394421-0
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5706924248-0.sdf |
| SMILES | MCULE-5706924248-0.smiles |
| Standard InChI | MCULE-5706924248-0.inchi |
| InChIKey | MCULE-5706924248-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-489195229 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596576914 | Key Organics | Building Blocks | 97 | As is | 25 g |
| P-31257164 | LaboTest | Screening Collection | 90 | As is | unavailable |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 424.504 |
| logP | 2.7386 |
| H-bond acceptors | 5 |
| H-bond donors | 0 |
| Rotatable bonds | 4 |
| PSA | 91.34 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 108.9355 |
| Atoms | 63 |
| Rings | 4 |
| Heavy atoms | 30 |
| Hydrogen atoms | 33 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| Inorganic atoms | 1 |
| Halogen atoms | 0 |
| Chiral centers | 8 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 8 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
