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MCULE-6452029122
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 | 39 USD | 90 | 22 working days | Get Quote |
| 5 mg | 57 USD | 90 | 22 working days | Get Quote |
| 10 mg | 72 USD | 90 | 22 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-6452029122.sdf |
| SMILES | MCULE-6452029122.smiles |
| Standard InChI | MCULE-6452029122.inchi |
| InChIKey | MCULE-6452029122.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-893062771 | N/A | As is | by synthesis |
| P-881618928 | N/A | As is | by synthesis |
| P-901347056 | 95 | As is | by synthesis |
| P-890226485 | 98 | As is | by synthesis |
| P-4472295 | 90 | As is | 2 mg |
| P-503061195 | 90 | As is | by synthesis |
| P-502658232 | 90 | As is | in stock |
| P-899784423 | 97 | As is | 50 mg |
| P-12531785 | 90 | As is | 50 mg |
| P-18873856 | 90 | As is | in stock |
| P-907215949 | 94 | As is | by resynthesis (? - ? days) |
| P-906859345 | 98 | As is | by synthesis |
| P-2189050 | 90 | As is | 97 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 314.721 |
| logP | 2.646 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 66.48 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 85.9012 |
| Atoms | 33 |
| Rings | 3 |
| Heavy atoms | 22 |
| Hydrogen atoms | 11 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| 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 |
