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MCULE-3815927256-0
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 | 72 USD | 97 | 11 working days | Get Quote |
| 5 mg | 72 USD | 97 | 11 working days | Get Quote |
| 10 mg | 72 USD | 97 | 11 working days | Get Quote |
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1
MCULE-3130344634-0
- Component type: Main
-
1
MCULE-6304532422-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-3815927256-0.sdf |
| SMILES | MCULE-3815927256-0.smiles |
| Standard InChI | MCULE-3815927256-0.inchi |
| InChIKey | MCULE-3815927256-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-597017008 | AEchem | Building blocks | 97 | As is | in stock |
| P-851032596 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
| P-868630933 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
| P-862126570 | FluoroChem | General BB | 97 | As is | in stock |
| P-854818325 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-851315255 | Chemshuttle | On request catalog | 95 | Main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 354.484 |
| logP | 4.2387 |
| H-bond acceptors | 6 |
| H-bond donors | 3 |
| Rotatable bonds | 9 |
| PSA | 101.65 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 100.3419 |
| Atoms | 59 |
| Rings | 1 |
| Heavy atoms | 25 |
| Hydrogen atoms | 34 |
| Heteroatoms | 6 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 3 |
| R/S chiral centers | 3 |
| 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 |
