Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7778289072
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 | 5 USD | 98 | 16 working days | Get Quote |
| 5 mg | 5 USD | 98 | 16 working days | Get Quote |
| 10 mg | 5 USD | 98 | 16 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-5810522404
- Component type: Main
-
1
MCULE-2199051150
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-7778289072.sdf |
| SMILES | MCULE-7778289072.smiles |
| Standard InChI | MCULE-7778289072.inchi |
| InChIKey | MCULE-7778289072.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867582733 | A2B Chem | Predominantly Building Block in stock | 98 | Main component | in stock |
| P-875741422 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-869181026 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-505392866 | AK Scientific | Building Blocks | 98 | Main component | in stock |
| P-608432199 | Aldlab Chemicals | Building Block Stock | 95 | Main component | 676.407 g |
| P-425214637 | Alinda | Stock Screening Compounds | 90 | Main component | in stock |
| P-606945558 | AmBeed | In stock | N/A | Main component | in stock |
| P-489170613 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | Main component | in stock |
| P-596953140 | Angene | Building Blocks in stock | 98 | Main component | 10.66 kg |
| P-494418776 | Apollo Scientific | On request | 95 | Main component | by resynthesis (? - ? days) |
| P-864187667 | AstaTech | In Stock BBs | 98 | Main component | in stock |
| P-580722242 | BLD pharm | In-stock building blocks | 98 | Main component | 575 g |
| P-448682016 | ChemDiv | Discovery Chemistry Library | 90 | Main component | 120 mg |
| P-868602999 | Combi-Blocks | Building Block in stock | 98 | Main component | in stock |
| P-862016669 | FluoroChem | General BB | N/A | Main component | in stock |
| P-579516756 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | Main component | in stock |
| P-505494273 | Hangzhou Apichem | Building Blocks in stock | 95 | Main component | in stock |
| P-502528394 | Innovapharm | Virtual Building Blocks | 95 | Main component | by synthesis |
| P-854740202 | MedChemExpress | In stock Building Blocks | 95 | Main component | in stock |
| P-889879524 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component | by synthesis |
| P-596790373 | Synthonix | In-stock Building Blocks | 95 | Main component | 11.48 kg |
| P-873222283 | TimTec | Building Block Collection | 90 | Main component | in stock |
| P-611434592 | Toronto Research | In stock | 90 | Main component | in stock |
| P-666974097 | eNovation Chemicals LLC | Building Blocks in stock | 98 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 196.242 |
| logP | 1.9683 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 2 |
| PSA | 57.53 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 55.8426 |
| Atoms | 30 |
| Rings | 1 |
| Heavy atoms | 14 |
| Hydrogen atoms | 16 |
| 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 |
