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MCULE-6777035412-0
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 | 11 USD | 98 | 22 working days | Get Quote |
| 5 mg | 11 USD | 98 | 22 working days | Get Quote |
| 10 mg | 11 USD | 98 | 22 working days | Get Quote |
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1
MCULE-2574311869-0
- Component type: Main
-
1
MCULE-2361956978-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-6777035412-0.sdf |
| SMILES | MCULE-6777035412-0.smiles |
| Standard InChI | MCULE-6777035412-0.inchi |
| InChIKey | MCULE-6777035412-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-869156386 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-888652860 | TargetMol | Screening Compounds - stock amount | 95 | As is | unavailable |
| P-872829203 | A2B Chem | Predominantly Building Block in stock | 98 | Main component | in stock |
| P-874640973 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-867720206 | AmBeed | In stock | N/A | Main component | in stock |
| P-865916306 | Angene | Building Blocks in stock | 98 | Main component | 1.5 kg |
| P-889589208 | AstaTech | In Stock BBs | 95 | Main component | in stock |
| P-855365948 | Toronto Research | In stock | 90 | Main component | in stock |
| P-855365980 | Toronto Research | In stock | 90 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 375.604 |
| logP | 5.8432 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 20 |
| PSA | 43.7 |
| RO5 violations | 1 |
| RO3 violations | 4 |
| Refractivity | 114.8336 |
| Atoms | 72 |
| Rings | 0 |
| Heavy atoms | 26 |
| Hydrogen atoms | 46 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
