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MCULE-8054527597
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 | 188 USD | 95 | 22 working days | Get Quote |
| 5 mg | 916 USD | 95 | 22 working days | Get Quote |
| 10 mg | 1515 USD | 95 | 22 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-8054527597.sdf |
| SMILES | MCULE-8054527597.smiles |
| Standard InChI | MCULE-8054527597.inchi |
| InChIKey | MCULE-8054527597.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867646645 | 95 | As is | in stock |
| P-613853552 | 95 | As is | by resynthesis (? - ? days) |
| P-1264056348 | 98 | As is | in stock |
| P-907352950 | 90 | As is | 24 mg |
| P-580236967 | 95 | As is | by synthesis |
| P-888820375 | 98 | As is | 5 mg |
| P-889522123 | 95 | As is | by synthesis |
| P-1273111165 | 97 | As is | 100 mg |
| P-892307137 | 95 | As is | in stock |
| P-869169836 | 95 | As is | unavailable |
| P-888662615 | 95 | As is | unavailable |
| P-611526093 | 90 | As is | in stock |
| P-611414865 | 90 | As is | in stock |
| P-868492080 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 372.497 |
| logP | 6.0661 |
| H-bond acceptors | 4 |
| H-bond donors | 3 |
| Rotatable bonds | 9 |
| PSA | 77.76 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 113.2553 |
| Atoms | 59 |
| Rings | 1 |
| Heavy atoms | 27 |
| Hydrogen atoms | 32 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 2 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 2 |
| Undefined stereo double bonds | 0 |
