Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8861497270-0
Structure
Show compound
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 | 86 USD | 95 | 22 working days | Get Quote |
| 5 mg | 86 USD | 95 | 22 working days | Get Quote |
| 10 mg | 86 USD | 95 | 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-8323882833-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-8861497270-0.sdf |
| SMILES | MCULE-8861497270-0.smiles |
| Standard InChI | MCULE-8861497270-0.inchi |
| InChIKey | MCULE-8861497270-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867648016 | 95 | As is | in stock |
| P-875815483 | N/A | As is | in stock |
| P-869251118 | 95 | As is | in stock |
| P-903178053 | 97 | As is | 1000 mg |
| P-905487807 | 95 | As is | 1000 mg |
| P-610965257 | 90 | As is | 51.382 g |
| P-606891441 | N/A | As is | in stock |
| P-619173284 | 97 | As is | 2 g |
| P-864161980 | 95 | As is | in stock |
| P-893222984 | 95 | As is | in stock |
| P-851316824 | 95 | As is | by synthesis |
| P-868620738 | 96 | As is | in stock |
| P-905324448 | 95 | As is | in stock |
| P-855953844 | 97 | As is | 1000 mg |
| P-468065332 | 95 | As is | 192 mg |
| P-601052538 | 90 | As is | 192 mg |
| P-895280902 | 95 | As is | by synthesis |
| P-888900956 | N/A | As is | in stock |
| P-904085522 | 97 | As is | 2.7 g |
| P-611581924 | 90 | As is | in stock |
| P-886959599 | 95 | As is | by synthesis |
| P-620776269 | N/A | Main component | by synthesis |
| P-904560383 | 95 | Main component | in stock |
| P-864222497 | 95 | Main component | by synthesis |
| P-591015151 | 95 | Main component | by synthesis |
| P-579522631 | 90 | Main component | 1 mg |
| P-890211458 | 90 | Main component | 1 mg |
| P-502496544 | 95 | Main component | by synthesis |
| P-524175093 | 95 | Main component | unavailable |
| P-579656876 | 95 | Main component | by resynthesis (? - ? days) |
| P-613279197 | 95 | Main component | by synthesis |
| P-895268712 | 95 | Main component | by synthesis |
| P-33985390 | 90 | Main component | in stock |
| P-502389002 | 90 | Main component | in stock |
| P-611565225 | 90 | Main component | in stock |
| P-886917470 | 95 | Main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 183.676 |
| logP | 2.5793 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 12.03 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 57.3967 |
| Atoms | 26 |
| Rings | 2 |
| Heavy atoms | 12 |
| Hydrogen atoms | 14 |
| Heteroatoms | 2 |
| N/O atoms | 1 |
| 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 |
