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MCULE-1662082148
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 | 95 USD | 98 | 22 working days | Get Quote |
| 5 mg | 95 USD | 98 | 22 working days | Get Quote |
| 10 mg | 126 USD | N/A | 14 working days | Get Quote |
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MCULE-4631144821
- Component type: Main
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MCULE-5419453222
- Component type: Main
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MCULE-3180298171
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1662082148.sdf |
| SMILES | MCULE-1662082148.smiles |
| Standard InChI | MCULE-1662082148.inchi |
| InChIKey | MCULE-1662082148.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-869148533 | 95 | As is | by synthesis |
| P-888649778 | 95 | As is | unavailable |
| P-867678360 | 98 | As a main component | in stock |
| P-852184812 | N/A | As a main component | by synthesis |
| P-874623544 | 99 | As a main component | in stock |
| P-878260730 | N/A | As a main component | in stock |
| P-873299756 | 98 | As a main component | 1.25 g |
| P-872725803 | 98 | As a main component | in stock |
| P-889788611 | 95 | As a main component | in stock |
| P-901531174 | 95 | As a main component | by synthesis |
| P-580450798 | 98 | As a main component | in stock |
| P-899783806 | 97 | As a main component | 100 mg |
| P-904221916 | 95 | As a main component | by synthesis |
| P-904238629 | 95 | As a main component | unavailable |
| P-855052218 | 90 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 448.546 |
| logP | 5.2776 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 9 |
| PSA | 15.71 |
| RO5 violations | 1 |
| RO3 violations | 3 |
| Refractivity | 136.472 |
| Atoms | 63 |
| Rings | 4 |
| Heavy atoms | 33 |
| Hydrogen atoms | 30 |
| 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 | 1 |
| Undefined stereo double bonds | 0 |
