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UNKNOWN STEREO
MCULE-1962102238-0
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 | 16 USD | 97 | 18 working days | Get Quote |
| 5 mg | 16 USD | 97 | 18 working days | Get Quote |
| 10 mg | 16 USD | 97 | 18 working days | Get Quote |
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1
MCULE-2932088896-2
- Component type: Main
-
2
MCULE-3833394421-0
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1962102238-0.sdf |
| SMILES | MCULE-1962102238-0.smiles |
| Standard InChI | MCULE-1962102238-0.inchi |
| InChIKey | MCULE-1962102238-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-869188579 | AK Scientific | Building Blocks | 97 | As is | in stock |
| P-505347376 | AK Scientific | Building Blocks | 99 | As is | in stock |
| P-889551750 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-675217041 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-893261991 | Biosynth | Synthesis | 95 | Main component as a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 225.152 |
| logP | 0.1504 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 89.21 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 43.6914 |
| Atoms | 24 |
| Rings | 1 |
| Heavy atoms | 15 |
| Hydrogen atoms | 9 |
| Heteroatoms | 6 |
| N/O atoms | 4 |
| Inorganic atoms | 2 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
