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MCULE-5546883881-0
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 | 33 USD | 90 | 17 working days | Get Quote |
| 5 mg | 50 USD | 90 | 17 working days | Get Quote |
| 10 mg | 64 USD | 90 | 17 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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1
MCULE-4463718254-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5546883881-0.sdf |
| SMILES | MCULE-5546883881-0.smiles |
| Standard InChI | MCULE-5546883881-0.inchi |
| InChIKey | MCULE-5546883881-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-488552270 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-24443273 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
| P-454369814 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-14039361 | Pharmeks LLC | Synthetic compounds | 92 | As is | in stock |
| P-617715842 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1.494 g |
| P-617779542 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.494 g |
| P-502503733 | Innovapharm | Virtual Building Blocks | 95 | Main component | by synthesis |
| P-520028971 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
| P-885519379 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 235.107 |
| logP | 3.2026 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 4 |
| PSA | 55.12 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 60.2441 |
| Atoms | 26 |
| Rings | 1 |
| Heavy atoms | 14 |
| Hydrogen atoms | 12 |
| Heteroatoms | 5 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
