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MCULE-1411085491-1
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 | 30 USD | 99 | 14 working days | Get Quote |
| 5 mg | 30 USD | 99 | 14 working days | Get Quote |
| 10 mg | 30 USD | 99 | 14 working days | Get Quote |
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MCULE-7265895908-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1411085491-1.sdf |
| SMILES | MCULE-1411085491-1.smiles |
| Standard InChI | MCULE-1411085491-1.inchi |
| InChIKey | MCULE-1411085491-1.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-590976119 | 95 | As is | by synthesis |
| P-903009732 | 99 | As a main component | 5 g |
| P-901918435 | 98 | As a main component | 2.74 g |
| P-871216524 | 95 | As a main component | by synthesis |
| P-1266987339 | 95 | As a main component | in stock |
| P-905361408 | 95 | As a main component | 2 g |
| P-861976437 | 95 | As a main component | 10.284 g |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 422.610 |
| logP | 0.8548 |
| H-bond acceptors | 8 |
| H-bond donors | 5 |
| Rotatable bonds | 3 |
| PSA | 132.24 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 85.7639 |
| Atoms | 37 |
| Rings | 3 |
| Heavy atoms | 24 |
| Hydrogen atoms | 13 |
| Heteroatoms | 10 |
| N/O atoms | 8 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| Chiral centers | 5 |
| R/S chiral centers | 5 |
| 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 |
