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UNKNOWN STEREO
MCULE-5961241266
Compound
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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 | 44 USD | 95 | 16 working days | Get Quote |
| 5 mg | 114 USD | 95 | 16 working days | Get Quote |
| 10 mg | 140 USD | 95 | 16 working days | Get Quote |
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1
MCULE-3556685775
- Component type: Main
-
2
MCULE-6572487779
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5961241266.sdf |
| SMILES | MCULE-5961241266.smiles |
| Standard InChI | MCULE-5961241266.inchi |
| InChIKey | MCULE-5961241266.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867648761 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875816896 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-860797925 | Chiralstar | Chiralstar Building Blocks | 98 | As is | in stock |
| P-888628958 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
| P-869110812 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
| P-611487488 | Toronto Research | In stock | 90 | As is | in stock |
| P-867722836 | AmBeed | On request | N/A | Main component | by synthesis |
| P-864331087 | AstaTech | Backordered BBs | 95 | Main component | by synthesis |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 712.759 |
| logP | 4.749 |
| H-bond acceptors | 14 |
| H-bond donors | 5 |
| Rotatable bonds | 10 |
| PSA | 229.29 |
| RO5 violations | 2 |
| RO3 violations | 6 |
| Refractivity | 167.6343 |
| Atoms | 86 |
| Rings | 4 |
| Heavy atoms | 47 |
| Hydrogen atoms | 39 |
| Heteroatoms | 19 |
| N/O atoms | 14 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| 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 |
