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UNKNOWN STEREO
MCULE-9080986641-0
Structure
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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 | 29 USD | 98 | 22 working days | Get Quote |
| 5 mg | 34 USD | 98 | 22 working days | Get Quote |
| 10 mg | 47 USD | 98 | 22 working days | Get Quote |
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1
MCULE-1272682982-0
- Component type: Main
-
2
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-9080986641-0.sdf |
| SMILES | MCULE-9080986641-0.smiles |
| Standard InChI | MCULE-9080986641-0.inchi |
| InChIKey | MCULE-9080986641-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-904223350 | 95 | As is | unavailable |
| P-904239357 | 95 | As is | unavailable |
| P-867566999 | 98 | Main component | in stock |
| P-875726856 | 98 | Main component | in stock |
| P-505401467 | 95 | Main component | by resynthesis (? - ? days) |
| P-590397890 | 98 | Main component | by resynthesis (? - ? days) |
| P-580192687 | 98 | Main component | in stock |
| P-606925188 | N/A | Main component | in stock |
| P-596947708 | 98 | Main component | 2 g |
| P-864119205 | 95 | Main component | in stock |
| P-872868380 | 99 | Main component | in stock |
| P-893234690 | 95 | Main component | in stock |
| P-860799569 | 98 | Main component | in stock |
| P-675214790 | 95 | Main component | in stock |
| P-869126124 | 95 | Main component | 591 mg |
| P-892290887 | 95 | Main component | 3.973 g |
| P-888639574 | 95 | Main component | 3.973 g |
| P-611424165 | 90 | Main component | in stock |
| P-480230861 | 98 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 1047.536 |
| logP | 13.0035 |
| H-bond acceptors | 14 |
| H-bond donors | 2 |
| Rotatable bonds | 18 |
| PSA | 170.42 |
| RO5 violations | 3 |
| RO3 violations | 5 |
| Refractivity | 276.5969 |
| Atoms | 124 |
| Rings | 7 |
| Heavy atoms | 67 |
| Hydrogen atoms | 57 |
| Heteroatoms | 20 |
| N/O atoms | 11 |
| Inorganic atoms | 0 |
| Halogen atoms | 6 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
