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MCULE-5121500825-0
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 | 312 USD | 90 | 25 working days | Get Quote |
| 5 mg | 340 USD | 94 | 23 working days | Get Quote |
| 10 mg | 414 USD | 90 | 25 working days | Get Quote |
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1
MCULE-7733905713-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5121500825-0.sdf |
| SMILES | MCULE-5121500825-0.smiles |
| Standard InChI | MCULE-5121500825-0.inchi |
| InChIKey | MCULE-5121500825-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-634111074 | Otava | Tangible screening compounds | 90 | As is | by synthesis |
| P-596435846 | Asinex | General screening catalog | 90 | Main component | 78 mg |
| P-502781576 | Innovapharm | Screening Compounds | 90 | Main component | in stock |
| P-642949192 | Otava | Tangible screening compounds | 90 | Main component | by synthesis |
| P-23335448 | TimTec | ActiMol 6 Week | 90 | Main component | in stock |
| P-873074425 | TimTec | ActiMol 4 Week - On demand | 94 | Main component | by resynthesis (? - ? days) |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 400.920 |
| logP | 5.0833 |
| H-bond acceptors | 6 |
| H-bond donors | 1 |
| Rotatable bonds | 9 |
| PSA | 97.92 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 107.1222 |
| Atoms | 51 |
| Rings | 2 |
| Heavy atoms | 26 |
| Hydrogen atoms | 25 |
| Heteroatoms | 8 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
