Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8722833276
Compound
Show structure
In order to add this molecule to a collection you have to create an account.
Sign up for free
- 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 | 40 USD | 90 | 22 working days | Get Quote |
| 5 mg | 58 USD | 90 | 22 working days | Get Quote |
| 10 mg | 73 USD | 90 | 22 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
- 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.
-
1
MCULE-2936643773
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-8722833276.sdf |
| SMILES | MCULE-8722833276.smiles |
| Standard InChI | MCULE-8722833276.inchi |
| InChIKey | MCULE-8722833276.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-872828785 | 98 | As is | in stock |
| P-875775443 | N/A | As is | in stock |
| P-869223352 | 98 | As is | in stock |
| P-903117264 | 98 | As is | 4 g |
| P-904313544 | 90 | As is | 6.043 g |
| P-606905844 | N/A | As is | in stock |
| P-489109632 | 97 | As is | in stock |
| P-873292985 | 98 | As is | 4 g |
| P-864166745 | 97 | As is | in stock |
| P-871194189 | 98 | As is | 2.2 g |
| P-901506948 | 95 | As is | by synthesis |
| P-617650009 | 90 | As is | in stock |
| P-619306832 | 90 | As is | 19 mg |
| P-851289020 | 95 | As is | by synthesis |
| P-861277759 | 95 | As is | in stock |
| P-861437037 | 95 | As is | by synthesis |
| P-34719794 | 90 | As is | in stock |
| P-580786498 | 90 | As is | by resynthesis (? - ? days) |
| P-675475642 | 90 | As is | in stock |
| P-500157140 | 96 | As is | in stock |
| P-852509963 | N/A | As is | in stock |
| P-854839515 | 95 | As is | by synthesis |
| P-889875619 | 95 | As is | by synthesis |
| P-502440646 | 90 | As is | in stock |
| P-873215048 | 90 | As is | in stock |
| P-611378841 | 90 | As is | in stock |
| P-617770067 | 90 | As is | 123 mg |
| P-667012990 | 95 | As is | in stock |
| P-852083425 | 99 | Main component | by synthesis |
| P-615730109 | 95 | Main component | in stock |
| P-851544952 | N/A | Main component | by synthesis |
| P-869394150 | 95 | Main component | by synthesis |
| P-851246515 | 95 | Main component | by synthesis |
| P-861277720 | 95 | Main component | in stock |
| P-861500983 | 95 | Main component | by synthesis |
| P-580296905 | 95 | Main component | by resynthesis (? - ? days) |
| P-905318963 | 95 | Main component | in stock |
| P-502529715 | 95 | Main component | by synthesis |
| P-500157139 | 96 | Main component | in stock |
| P-563585238 | 95 | Main component | 1000 mg |
| P-852522066 | N/A | Main component | in stock |
| P-854762172 | 95 | Main component | by synthesis |
| P-611576428 | 90 | Main component | in stock |
| P-893944817 | 95 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 210.658 |
| logP | 3.3026 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 52.05 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 56.5774 |
| Atoms | 25 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 11 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| 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 |
