Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6706083805
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 | 6 USD | 98 | 14 working days | Get Quote |
| 5 mg | 6 USD | 98 | 14 working days | Get Quote |
| 10 mg | 6 USD | 98 | 14 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-7463916552
- Component type: Main
-
2
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-6706083805.sdf |
| SMILES | MCULE-6706083805.smiles |
| Standard InChI | MCULE-6706083805.inchi |
| InChIKey | MCULE-6706083805.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-875765145 | N/A | As is | in stock |
| P-590389470 | 98 | As is | in stock |
| P-903102267 | 98 | As is | 100 g |
| P-489227191 | 97 | As is | in stock |
| P-596961145 | 98 | As is | 100 g |
| P-872724575 | 98 | As is | in stock |
| P-864110792 | 98 | As is | in stock |
| P-893233219 | 95 | As is | in stock |
| P-851278245 | 95 | As is | by synthesis |
| P-868592195 | 98 | As is | in stock |
| P-896538239 | 95 | As is | 85 g |
| P-505545253 | 95 | As is | in stock |
| P-856009875 | 98 | As is | 100 mg |
| P-608083373 | 99 | As is | unavailable |
| P-852444456 | N/A | As is | in stock |
| P-902984038 | 95 | As is | by synthesis |
| P-899992569 | 95 | As is | in stock |
| P-474024798 | 95 | As is | in stock |
| P-608269985 | 98 | As is | in stock |
| P-500405791 | 99 | As is | by synthesis |
| P-500392503 | 98 | As is | by synthesis |
| P-885539516 | 95 | As is | by synthesis |
| P-579710570 | N/A | As is | in stock |
| P-869109922 | 95 | As is | by synthesis |
| P-892287432 | 95 | As is | 669 mg |
| P-888628385 | 95 | As is | 669 mg |
| P-906756533 | 98 | As is | by synthesis |
| P-611432432 | 90 | As is | in stock |
| P-480989463 | 95 | As is | in stock |
| P-872835146 | 95 | Main component | in stock |
| P-875830221 | N/A | Main component | in stock |
| P-903205478 | 95 | Main component | 175 mg |
| P-893607557 | 90 | Main component | 300 mg |
| P-619164636 | 95 | Main component | 100 mg |
| P-872696849 | 95 | Main component | in stock |
| P-893620236 | 96 | Main component | in stock |
| P-579479666 | 95 | Main component | in stock |
| P-590341158 | 90 | Main component | 1000 mg |
| P-890218729 | 90 | Main component | in stock |
| P-855927368 | 95 | Main component | 1000 mg |
| P-899990462 | 95 | Main component | by synthesis |
| P-859995129 | 95 | Main component | by synthesis |
| P-498639745 | 95 | Main component | by synthesis |
| P-869160553 | 95 | Main component | by synthesis |
| P-892294667 | 95 | Main component | unavailable |
| P-888655816 | 95 | Main component | 16 mg |
| P-892939550 | N/A | Main component as a main component | by synthesis |
| P-893252983 | 95 | Main component as a main component | by synthesis |
| P-870652653 | 97 | Main component as a main component | in stock |
| P-31194744 | 90 | Main component as a main component | 2 g |
| P-856045700 | 90 | Main component as a main component | 2 g |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 463.864 |
| logP | 7.0354 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 5 |
| PSA | 6.48 |
| RO5 violations | 1 |
| RO3 violations | 3 |
| Refractivity | 139.831 |
| Atoms | 59 |
| Rings | 4 |
| Heavy atoms | 30 |
| Hydrogen atoms | 29 |
| Heteroatoms | 5 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
