MCULE-9547297783
- 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 | 25 USD | 98 | 20 working days | Get Quote |
| 5 mg | 25 USD | 98 | 20 working days | Get Quote |
| 10 mg | 30 USD | 98 | 20 working days | Get Quote |
- 1-Click Docking Predict the binding orientation and affinity of the ligand to a target.
- Toxicity checker Searching for substructures commonly found in toxic and promiscuous ligands.
- Property calculator Create a physicochemical property profile for the compound in a second.
- Similarity search Find analogs by similarity search.
- Substructure search Find analogs by substructure search.
| Name | File |
|---|---|
| SDF | MCULE-9547297783.sdf |
| SMILES | MCULE-9547297783.smiles |
| Standard InChI | MCULE-9547297783.inchi |
| InChIKey | MCULE-9547297783.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867567873 | 98 | As is | in stock |
| P-875727864 | N/A | As is | in stock |
| P-595214761 | 95 | As is | in stock |
| P-903056768 | 99 | As is | 5 g |
| P-893442636 | 90 | As is | 21.883 g |
| P-489137136 | 97 | As is | in stock |
| P-596982885 | 98 | As is | 3 g |
| P-580195036 | 98 | As is | in stock |
| P-889548961 | 98 | As is | in stock |
| P-860056198 | 98 | As is | by synthesis |
| P-871219105 | N/A | As is | by resynthesis (? - ? days) |
| P-893231203 | 95 | As is | in stock |
| P-5167650 | 90 | As is | 100 mg |
| P-448714261 | 90 | As is | 1.556 g |
| P-425291126 | 90 | As is | in stock |
| P-19884763 | 90 | As is | in stock |
| P-851265400 | 95 | As is | by synthesis |
| P-860798428 | 98 | As is | in stock |
| P-580452320 | 98 | As is | in stock |
| P-887186104 | 95 | As is | by synthesis |
| P-34828751 | 90 | As is | by synthesis |
| P-579478831 | 95 | As is | in stock |
| P-675216176 | 95 | As is | in stock |
| P-12730612 | 95 | As is | 28 mg |
| P-596582997 | 97 | As is | 50 mg |
| P-1263153338 | 95 | As is | by synthesis |
| P-854713965 | 95 | As is | in stock |
| P-584619599 | 95 | As is | in stock |
| P-878641472 | 98 | As is | in stock |
| P-626306348 | 90 | As is | by synthesis |
| P-491318758 | 95 | As is | by synthesis |
| P-18971881 | 90 | As is | in stock |
| P-579711357 | N/A | As is | in stock |
| P-869162241 | 95 | As is | by synthesis |
| P-892297347 | 95 | As is | unavailable |
| P-888657623 | 95 | As is | 138 mg |
| P-22852753 | 90 | As is | in stock |
| P-888493756 | 94 | As is | by resynthesis (? - ? days) |
| P-611416487 | 90 | As is | in stock |
| P-611416046 | 90 | As is | in stock |
| P-912334268 | 90 | As is | by synthesis |
| P-613771 | 90 | As is | 727 mg |
| P-615451034 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 355.391 |
| logP | 1.2688 |
| H-bond acceptors | 8 |
| H-bond donors | 1 |
| Rotatable bonds | 5 |
| PSA | 90.92 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 100.4527 |
| Atoms | 47 |
| Rings | 3 |
| Heavy atoms | 26 |
| Hydrogen atoms | 21 |
| Heteroatoms | 8 |
| N/O atoms | 8 |
| 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 |

