MCULE-8530532855-0
- 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 | 25 USD | 95 | 22 working days | Get Quote |
| 5 mg | 28 USD | 98 | 22 working days | Get Quote |
| 10 mg | 43 USD | 98 | 22 working days | Get Quote |
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1
MCULE-7835163541-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-8530532855-0.sdf |
| SMILES | MCULE-8530532855-0.smiles |
| Standard InChI | MCULE-8530532855-0.inchi |
| InChIKey | MCULE-8530532855-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867535099 | N/A | As is | in stock |
| P-875689716 | 98 | As is | in stock |
| P-893510657 | 90 | As is | 57.74 g |
| P-1270300884 | 98 | As is | in stock |
| P-1264204089 | N/A | As is | by synthesis |
| P-489148487 | 97 | As is | in stock |
| P-619135210 | 99 | As is | 26 g |
| P-1273452165 | 95 | As is | by resynthesis (? - ? days) |
| P-1273457816 | 95 | As is | by resynthesis (? - ? days) |
| P-864190001 | 95 | As is | in stock |
| P-901457979 | 95 | As is | by synthesis |
| P-861568182 | 95 | As is | by synthesis |
| P-860797934 | 98 | As is | in stock |
| P-861379001 | 95 | As is | by synthesis |
| P-608496406 | 95 | As is | in stock |
| P-901409540 | 98 | As is | 26 g |
| P-870659234 | N/A | As is | in stock |
| P-855913860 | 97 | As is | 1 mg |
| P-852445508 | N/A | As is | by synthesis |
| P-854711860 | 95 | As is | in stock |
| P-1263156146 | 95 | As is | by synthesis |
| P-584618665 | 95 | As is | in stock |
| P-888169007 | 98 | As is | by synthesis |
| P-885544013 | 95 | As is | by synthesis |
| P-892298792 | 95 | As is | unavailable |
| P-869162947 | 95 | As is | 51 mg |
| P-888658404 | 95 | As is | 51 mg |
| P-1271719913 | 98 | As is | in stock |
| P-867535098 | 95 | Main component | in stock |
| P-875689715 | 95 | Main component | in stock |
| P-903010654 | 95 | Main component | 150 mg |
| P-610959388 | 90 | Main component | 98.524 g |
| P-1270329720 | 95 | Main component | in stock |
| P-851930380 | N/A | Main component | in stock |
| P-619135209 | 95 | Main component | 100 mg |
| P-1273452066 | 95 | Main component | by resynthesis (? - ? days) |
| P-864160414 | 95 | Main component | in stock |
| P-901431312 | 95 | Main component | by synthesis |
| P-851314933 | 95 | Main component | by synthesis |
| P-860797931 | 98 | Main component | in stock |
| P-887162472 | 95 | Main component | by synthesis |
| P-901407111 | 95 | Main component | 150 mg |
| P-870652483 | N/A | Main component | in stock |
| P-868079463 | 95 | Main component | in stock |
| P-855913859 | 95 | Main component | 1 mg |
| P-854717176 | 95 | Main component | in stock |
| P-1263155456 | 95 | Main component | by synthesis |
| P-896071371 | 95 | Main component | in stock |
| P-608269664 | 98 | Main component | in stock |
| P-617405027 | 98 | Main component | in stock |
| P-892298399 | 95 | Main component | unavailable |
| P-594275535 | 95 | Main component | 147 mg |
| P-888658135 | 95 | Main component | 147 mg |
| P-480981744 | 97 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 259.732 |
| logP | 3.48248 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 1 |
| PSA | 41.61 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 72.122 |
| Atoms | 32 |
| Rings | 3 |
| Heavy atoms | 18 |
| Hydrogen atoms | 14 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| 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 |

