MCULE-6557346547-0
- 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 | 19 USD | 92 | 18 working days | Get Quote |
| 5 mg | 29 USD | 92 | 18 working days | Get Quote |
| 10 mg | 36 USD | 92 | 18 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-6557346547-0.sdf |
| SMILES | MCULE-6557346547-0.smiles |
| Standard InChI | MCULE-6557346547-0.inchi |
| InChIKey | MCULE-6557346547-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886628172 | 95 | As is | in stock |
| P-889934079 | 95 | As is | by synthesis |
| P-613850635 | 95 | As is | by resynthesis (? - ? days) |
| P-1264594715 | 95 | As is | 5 g |
| P-893454652 | 90 | As is | 10.274 g |
| P-851415863 | N/A | As is | by synthesis |
| P-489150483 | 97 | As is | in stock |
| P-889801037 | 95 | As is | by synthesis |
| P-590743269 | 95 | As is | by synthesis |
| P-4206648 | 90 | As is | 10 mg |
| P-619932406 | 90 | As is | by synthesis |
| P-4547754 | 90 | As is | 28 mg |
| P-181757 | 90 | As is | 295 mg |
| P-436464480 | 95 | As is | in stock |
| P-34864307 | 90 | As is | in stock |
| P-868636324 | 95 | As is | in stock |
| P-34799343 | 90 | As is | by synthesis |
| P-580441889 | 95 | As is | by resynthesis (? - ? days) |
| P-503008465 | 90 | As is | by synthesis |
| P-12538184 | 92 | As is | 300 mg |
| P-18764329 | 90 | As is | 533 mg |
| P-467964835 | 95 | As is | 2.26 g |
| P-14169285 | 90 | As is | 2.26 g |
| P-852445982 | N/A | As is | by synthesis |
| P-895290149 | 95 | As is | by synthesis |
| P-13119411 | 90 | As is | 41 mg |
| P-23787804 | 92 | As is | 300 mg |
| P-18889949 | 90 | As is | in stock |
| P-23380445 | 90 | As is | 13 mg |
| P-502326884 | 90 | As is | in stock |
| P-22463236 | 90 | As is | 1000 mg |
| P-611608156 | 90 | As is | in stock |
| P-1833239 | 90 | As is | 136 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 224.257 |
| logP | 3.1419 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 37.91 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 67.0727 |
| Atoms | 29 |
| Rings | 3 |
| Heavy atoms | 17 |
| Hydrogen atoms | 12 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |

