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MCULE-1955114168-0
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 | 55 USD | 98 | 22 working days | Get Quote |
| 5 mg | 123 USD | 95 | 12 working days | Get Quote |
| 10 mg | 206 USD | 95 | 12 working days | Get Quote |
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MCULE-8104715066-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1955114168-0.sdf |
| SMILES | MCULE-1955114168-0.smiles |
| Standard InChI | MCULE-1955114168-0.inchi |
| InChIKey | MCULE-1955114168-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867595159 | 98 | As a main component | in stock |
| P-869265340 | 95 | As a main component | by resynthesis (? - ? days) |
| P-904320591 | 90 | As a main component | 5.994 g |
| P-895095188 | N/A | As a main component | 100 mg |
| P-1274824114 | 95 | As a main component | by resynthesis (? - ? days) |
| P-889520881 | 95 | As a main component | by synthesis |
| P-870661547 | N/A | As a main component | in stock |
| P-1273110611 | 97 | As a main component | 100 mg |
| P-888171155 | 98 | As a main component | by synthesis |
| P-904247762 | 95 | As a main component | unavailable |
| P-869129025 | 95 | As a main component | 1.987 g |
| P-888641503 | 95 | As a main component | 1.974 g |
| P-855053219 | 90 | As a main component | in stock |
| P-1271622964 | 99 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 405.488 |
| logP | 3.5847 |
| H-bond acceptors | 6 |
| H-bond donors | 0 |
| Rotatable bonds | 3 |
| PSA | 57.75 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 119.051 |
| Atoms | 57 |
| Rings | 4 |
| Heavy atoms | 30 |
| Hydrogen atoms | 27 |
| Heteroatoms | 6 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
