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MCULE-1042010453
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 | 503 USD | 95 | 22 working days | Get Quote |
| 5 mg | 503 USD | 95 | 22 working days | Get Quote |
| 10 mg | 503 USD | 95 | 22 working days | Get Quote |
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1
MCULE-2102946676
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1042010453.sdf |
| SMILES | MCULE-1042010453.smiles |
| Standard InChI | MCULE-1042010453.inchi |
| InChIKey | MCULE-1042010453.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-881625932 | N/A | As is | by synthesis |
| P-869400284 | 95 | As is | by synthesis |
| P-890234422 | 95 | As is | by synthesis |
| P-854969118 | 90 | As is | in stock |
| P-854969121 | 90 | As is | in stock |
| P-1271503894 | 95 | As is | by synthesis |
| P-904539069 | 95 | Main component | by resynthesis (? - ? days) |
| P-851766791 | N/A | Main component | by synthesis |
| P-489192954 | 97 | Main component | in stock |
| P-869400283 | 95 | Main component | by synthesis |
| P-591131491 | 95 | Main component | by synthesis |
| P-867705792 | 95 | Main component | by synthesis |
| P-1267007208 | 95 | Main component | by synthesis |
| P-856070540 | 95 | Main component | in stock |
| P-892270524 | 95 | Main component | unavailable |
| P-892348473 | 95 | Main component | unavailable |
| P-1271464208 | 95 | Main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 209.713 |
| logP | 2.9867 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 12.03 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 64.9387 |
| Atoms | 30 |
| Rings | 3 |
| Heavy atoms | 14 |
| Hydrogen atoms | 16 |
| Heteroatoms | 2 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 2 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 2 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
