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MCULE-3462480996-0
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 | 35 USD | 90 | 19 working days | Get Quote |
| 5 mg | 52 USD | 90 | 19 working days | Get Quote |
| 10 mg | 65 USD | 90 | 19 working days | Get Quote |
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1
MCULE-8501199235-0
- Component type: Main
-
1
MCULE-6647815245-2
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-3462480996-0.sdf |
| SMILES | MCULE-3462480996-0.smiles |
| Standard InChI | MCULE-3462480996-0.inchi |
| InChIKey | MCULE-3462480996-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-892485240 | Asinex | General screening catalog | 90 | As is | 52 mg |
| P-617737016 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 32 mg |
| P-885948929 | A2B Chem | Predominantly Building Block on demand | 95 | Main component | by synthesis |
| P-889960419 | AA Blocks | AA Blocks - synthesis | N/A | Main component | by synthesis |
| P-596495451 | Asinex | General bb catalog | 90 | Main component | unavailable |
| P-502540778 | Innovapharm | Virtual Building Blocks | 95 | Main component | by synthesis |
| P-492228889 | Innovapharm | Building Blocks | 95 | Main component | in stock |
| P-12414532 | Otava | In-House Stock Library | 90 | Main component | 1000 mg |
| P-502333544 | TimTec | Building Block Collection | 90 | Main component | in stock |
| P-3430475 | ChemBridge | EXPRESS-Pick Collection | 90 | Main component as a main component | 50 mg |
| P-424409363 | Otava | In-House Stock Library | 90 | Main component as a main component | 50 mg |
| P-617595621 | Specs | Screening Compounds | 90 | Main component as a main component | 303 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 311.715 |
| logP | 2.7693 |
| H-bond acceptors | 6 |
| H-bond donors | 3 |
| Rotatable bonds | 5 |
| PSA | 99.77 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 76.0513 |
| Atoms | 35 |
| Rings | 2 |
| Heavy atoms | 21 |
| Hydrogen atoms | 14 |
| Heteroatoms | 7 |
| 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 |
