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MCULE-1789660998-0
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 | 40 USD | 90 | 22 working days | Get Quote |
| 5 mg | 58 USD | 90 | 22 working days | Get Quote |
| 10 mg | 73 USD | 90 | 22 working days | Get Quote |
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1
MCULE-8144281356-0
- Component type: Main
-
2
MCULE-6124492894-0
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1789660998-0.sdf |
| SMILES | MCULE-1789660998-0.smiles |
| Standard InChI | MCULE-1789660998-0.inchi |
| InChIKey | MCULE-1789660998-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-675373060 | 90 | As is | in stock |
| P-637408083 | 90 | As is | by synthesis |
| P-18822967 | 90 | As is | in stock |
| P-907232439 | 94 | As is | by resynthesis (? - ? days) |
| P-393124 | 90 | As is | 46 mg |
| P-622930307 | 90 | Main component as a main component | by synthesis |
| P-18951883 | 90 | Main component as a main component | in stock |
| P-534778 | 90 | Main component as a main component | 49 mg |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 554.272 |
| logP | 1.6565 |
| H-bond acceptors | 4 |
| H-bond donors | 0 |
| Rotatable bonds | 7 |
| PSA | 41.9 |
| RO5 violations | 1 |
| RO3 violations | 3 |
| Refractivity | 138.569 |
| Atoms | 54 |
| Rings | 4 |
| Heavy atoms | 32 |
| Hydrogen atoms | 22 |
| Heteroatoms | 6 |
| N/O atoms | 4 |
| 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 |
