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MCULE-5113268429
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 | 65 USD | 95 | 14 working days | Get Quote |
| 5 mg | 65 USD | 95 | 14 working days | Get Quote |
| 10 mg | 65 USD | 95 | 14 working days | Get Quote |
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1
MCULE-3126959974
- Component type: Main
-
2
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5113268429.sdf |
| SMILES | MCULE-5113268429.smiles |
| Standard InChI | MCULE-5113268429.inchi |
| InChIKey | MCULE-5113268429.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-875790326 | 97 | As is | in stock |
| P-869299682 | 95 | As is | by resynthesis (? - ? days) |
| P-903141490 | 95 | As is | 10 g |
| P-904335674 | 90 | As is | 118 mg |
| P-851874402 | N/A | As is | by synthesis |
| P-489139829 | 97 | As is | in stock |
| P-864090318 | 96 | As is | in stock |
| P-591013804 | 95 | As is | by synthesis |
| P-901438916 | 95 | As is | by synthesis |
| P-868646104 | 96 | As is | in stock |
| P-563529953 | 95 | As is | 250 mg |
| P-854723711 | 95 | As is | in stock |
| P-611371868 | 90 | As is | in stock |
| P-1271636155 | 97 | As is | in stock |
| P-872831856 | N/A | Main component | in stock |
| P-875810937 | N/A | Main component | in stock |
| P-904529199 | 95 | Main component | by resynthesis (? - ? days) |
| P-851558274 | N/A | Main component | by synthesis |
| P-590919414 | 95 | Main component | by synthesis |
| P-895605187 | 95 | Main component | by synthesis |
| P-851812573 | N/A | Main component as a main component | by synthesis |
| P-591115830 | 97 | Main component as a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 222.112 |
| logP | 3.5337 |
| H-bond acceptors | 3 |
| H-bond donors | 3 |
| Rotatable bonds | 2 |
| PSA | 75.89 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 59.3095 |
| Atoms | 26 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 13 |
| Heteroatoms | 5 |
| N/O atoms | 3 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 1 |
