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UNKNOWN STEREO
MCULE-6616289029-0
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 | 45 USD | 90 | 23 working days | Get Quote |
| 5 mg | 72 USD | 90 | 23 working days | Get Quote |
| 10 mg | 87 USD | 90 | 23 working days | Get Quote |
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1
MCULE-2783880335-0
- Component type: Main
-
1
MCULE-6647815245-2
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-6616289029-0.sdf |
| SMILES | MCULE-6616289029-0.smiles |
| Standard InChI | MCULE-6616289029-0.inchi |
| InChIKey | MCULE-6616289029-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-886762584 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-890189317 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-890851947 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-881189319 | Otava | In-House Stock Library | 90 | As is | 50 mg |
| P-881620710 | AmBeed | On request | N/A | Main component | by synthesis |
| P-611489228 | Toronto Research | In stock | 90 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 445.496 |
| logP | 2.0918 |
| H-bond acceptors | 12 |
| H-bond donors | 4 |
| Rotatable bonds | 6 |
| PSA | 252.39 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 96.3624 |
| Atoms | 46 |
| Rings | 2 |
| Heavy atoms | 27 |
| Hydrogen atoms | 19 |
| Heteroatoms | 15 |
| N/O atoms | 12 |
| Inorganic atoms | 0 |
| 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 |
