Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2474047176-0
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 | 41 USD | 90 | 22 working days | Get Quote |
| 5 mg | 54 USD | 90 | 22 working days | Get Quote |
| 10 mg | 59 USD | 97 | 11 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-3597733450-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-2474047176-0.sdf |
| SMILES | MCULE-2474047176-0.smiles |
| Standard InChI | MCULE-2474047176-0.inchi |
| InChIKey | MCULE-2474047176-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-885954972 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
| P-894614072 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-851656097 | AmBeed | On request | N/A | As is | by synthesis |
| P-617427333 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
| P-854897141 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-886586542 | A2B Chem | Predominantly Building Block in stock | 98 | Main component | in stock |
| P-875771800 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-590393197 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-903112923 | Aaron Chemicals LLC | Predominantly Building Block | 98 | Main component | 15 g |
| P-904313301 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | Main component | 15 g |
| P-851583681 | AmBeed | On request | N/A | Main component | by synthesis |
| P-489202643 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | Main component | in stock |
| P-597006097 | Angene | Building Blocks in stock | 98 | Main component | 15 g |
| P-889467431 | AstaTech | Backordered BBs | 95 | Main component | by synthesis |
| P-590913176 | BLD pharm | Non-stock building blocks | 97 | Main component | by synthesis |
| P-492255472 | ChemBridge | Building Block Library | 95 | Main component | in stock |
| P-4149776 | ChemBridge | EXPRESS-Pick Collection | 90 | Main component | 100 mg |
| P-868565318 | Combi-Blocks | Building Block in stock | 97 | Main component | in stock |
| P-862000879 | FluoroChem | General BB | N/A | Main component | in stock |
| P-502536955 | Innovapharm | Virtual Building Blocks | 95 | Main component | by synthesis |
| P-596565053 | Key Organics | Building Blocks | 97 | Main component | 5 g |
| P-580497663 | Manchester Organics | Compounds on demand | 95 | Main component | by synthesis |
| P-852607506 | Matrix Scientific | All | N/A | Main component | in stock |
| P-854790559 | MedChemExpress | Building Blocks on demand | 95 | Main component | by synthesis |
| P-502381296 | TimTec | Building Block Collection | 90 | Main component | in stock |
| P-611386219 | Toronto Research | In stock | 90 | Main component | in stock |
| P-575293265 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 215.076 |
| logP | 3.8536 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 38.91 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 58.1224 |
| Atoms | 21 |
| Rings | 2 |
| Heavy atoms | 13 |
| Hydrogen atoms | 8 |
| Heteroatoms | 4 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
