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UNKNOWN STEREO
MCULE-7644825922
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 | 245 USD | N/A | 20 working days | Get Quote |
| 5 mg | 468 USD | N/A | 20 working days | Get Quote |
| 10 mg | 661 USD | N/A | 20 working days | Get Quote |
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1
MCULE-8121071078
- Component type: Main
-
1
MCULE-3169739755
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-7644825922.sdf |
| SMILES | MCULE-7644825922.smiles |
| Standard InChI | MCULE-7644825922.inchi |
| InChIKey | MCULE-7644825922.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1274346890 | 95 | As is | unavailable |
| P-1274357548 | 95 | As is | unavailable |
| P-867647761 | 98 | Main component | in stock |
| P-875815184 | 98 | Main component | in stock |
| P-874637183 | N/A | Main component | by resynthesis (? - ? days) |
| P-891666742 | N/A | Main component | by synthesis |
| P-895102768 | N/A | Main component | 100 mg |
| P-889522094 | 95 | Main component | by synthesis |
| P-869108551 | 95 | Main component | 496 mg |
| P-888627492 | 95 | Main component | 494 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 402.294 |
| logP | 4.2043 |
| H-bond acceptors | 6 |
| H-bond donors | 2 |
| Rotatable bonds | 2 |
| PSA | 90.91 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 104.6095 |
| Atoms | 42 |
| Rings | 4 |
| Heavy atoms | 25 |
| Hydrogen atoms | 17 |
| Heteroatoms | 9 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| Chiral centers | 2 |
| R/S chiral centers | 2 |
| 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 |
