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UNKNOWN STEREO
MCULE-1102928163
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 | 43 USD | N/A | 9 working days | Get Quote |
| 5 mg | 123 USD | N/A | 9 working days | Get Quote |
| 10 mg | 135 USD | 98 | 20 working days | Get Quote |
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MCULE-9737534526
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1102928163.sdf |
| SMILES | MCULE-1102928163.smiles |
| Standard InChI | MCULE-1102928163.inchi |
| InChIKey | MCULE-1102928163.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867680945 | 98 | As is | in stock |
| P-875858757 | N/A | As is | in stock |
| P-894642557 | 95 | As is | in stock |
| P-892510121 | N/A | As is | in stock |
| P-895106508 | 98 | As is | 1000 mg |
| P-896024768 | 95 | As is | in stock |
| P-872868362 | 99 | As is | in stock |
| P-901422578 | 95 | As is | by synthesis |
| P-675215265 | 95 | As is | in stock |
| P-869108876 | 95 | As is | by synthesis |
| P-892287098 | 95 | As is | unavailable |
| P-888627698 | 95 | As is | 99 mg |
| P-611503838 | 90 | As is | in stock |
| P-893982588 | 95 | As is | in stock |
| P-869108877 | 95 | As a main component | by synthesis |
| P-888627699 | 95 | As a main component | unavailable |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 429.941 |
| logP | 4.2781 |
| H-bond acceptors | 7 |
| H-bond donors | 2 |
| Rotatable bonds | 6 |
| PSA | 88.91 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 117.5924 |
| Atoms | 58 |
| Rings | 4 |
| Heavy atoms | 30 |
| Hydrogen atoms | 28 |
| Heteroatoms | 8 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 2 |
| R/S chiral centers | 2 |
| 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 |
