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MCULE-7969581897
Compound
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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 | 39 USD | 95 | 15 working days | Get Quote |
| 5 mg | 58 USD | 90 | 22 working days | Get Quote |
| 10 mg | 73 USD | 90 | 22 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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1
MCULE-6365629241
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-7969581897.sdf |
| SMILES | MCULE-7969581897.smiles |
| Standard InChI | MCULE-7969581897.inchi |
| InChIKey | MCULE-7969581897.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-24169139 | 95 | As is | 30 mg |
| P-596365063 | 90 | Main component | 58 mg |
| P-596489957 | 90 | Main component | 58 mg |
| P-579437571 | 90 | Main component | in stock |
| P-454012411 | 90 | Main component | 5 mg |
| P-888353406 | 94 | Main component | by resynthesis (? - ? days) |
| P-24817123 | 90 | Main component | 15 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 315.834 |
| logP | 3.0508 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 6 |
| PSA | 41.93 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 90.7058 |
| Atoms | 47 |
| Rings | 2 |
| Heavy atoms | 21 |
| Hydrogen atoms | 26 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
