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MCULE-7776729550
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 | 79 USD | 90 | 22 working days | Get Quote |
| 5 mg | 114 USD | 90 | 22 working days | Get Quote |
| 10 mg | 165 USD | 90 | 17 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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| Name | File |
|---|---|
| SDF | MCULE-7776729550.sdf |
| SMILES | MCULE-7776729550.smiles |
| Standard InChI | MCULE-7776729550.inchi |
| InChIKey | MCULE-7776729550.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867427345 | 95 | As is | by synthesis |
| P-904614903 | 95 | As is | in stock |
| P-893469828 | 90 | As is | 590 mg |
| P-851717056 | N/A | As is | by synthesis |
| P-591115409 | 95 | As is | by synthesis |
| P-3566249 | 90 | As is | 5 mg |
| P-502683449 | 90 | As is | in stock |
| P-601050382 | 90 | As is | 184 mg |
| P-468062058 | 95 | As is | 184 mg |
| P-852511183 | N/A | As is | in stock |
| P-895261238 | 95 | As is | by synthesis |
| P-33839954 | 90 | As is | in stock |
| P-907228637 | 94 | As is | by resynthesis (? - ? days) |
| P-855251472 | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 224.299 |
| logP | 2.1622 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 49.41 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 69.8867 |
| Atoms | 36 |
| Rings | 2 |
| Heavy atoms | 16 |
| Hydrogen atoms | 20 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
