Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2244989581
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 | 28 USD | 97 | 27 working days | Get Quote |
| 5 mg | 28 USD | 97 | 27 working days | Get Quote |
| 10 mg | 28 USD | 97 | 27 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.
| Name | File |
|---|---|
| SDF | MCULE-2244989581.sdf |
| SMILES | MCULE-2244989581.smiles |
| Standard InChI | MCULE-2244989581.inchi |
| InChIKey | MCULE-2244989581.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-852095590 | A2B Chem | Predominantly Building Block on demand | 97 | As is | by synthesis |
| P-901196415 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
| P-590357492 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-436447642 | Alinda | Building Blocks | 95 | As is | 25 g |
| P-20010434 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-851666330 | AmBeed | On request | N/A | As is | by synthesis |
| P-901339670 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-591020268 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
| P-427959028 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 5 mg |
| P-454755132 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-454695012 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-607760917 | ChemDiv | Discovery Chemistry Library | 90 | As is | 7 mg |
| P-861470114 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-34795337 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
| P-580764745 | Crea-Chim | Prepacked BB compounds with prompt delivery | 90 | As is | in stock |
| P-580775263 | Crea-Chim | Building Blocks | 90 | As is | by resynthesis (? - ? days) |
| P-861930075 | FluoroChem | General BB | N/A | As is | in stock |
| P-502448132 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-502782545 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-492215013 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-596579985 | Key Organics | Building Blocks | 97 | As is | 1000 mg |
| P-870640925 | Key Organics | Screening Compounds and Fragments | 97 | As is | 100 mg |
| P-14414144 | Life Chemicals | Screening Compounds | 90 | As is | 87.984 g |
| P-468062026 | Life Chemicals | Building Blocks | 95 | As is | 87.984 g |
| P-580476866 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852397899 | Matrix Scientific | All | N/A | As is | in stock |
| P-896546873 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-492276486 | Otava | Chemical Building Blocks for Prompt Delivery | 96 | As is | 6.15 g |
| P-12413401 | Otava | In-House Stock Library | 90 | As is | 6.15 g |
| P-19205541 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-596794359 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-902820866 | Specs | Natural Products | 80 | As is | 40 mg |
| P-12734946 | Specs | Screening Compounds | 90 | As is | 40 mg |
| P-33465046 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-502341709 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-888432789 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-888433050 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-855220463 | Toronto Research | In stock | 90 | As is | in stock |
| P-1022294 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 2.788 g |
| P-3230707 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 2.788 g |
| P-615417101 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 247.315 |
| logP | 3.6735 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 80.56 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 70.4049 |
| Atoms | 30 |
| Rings | 2 |
| Heavy atoms | 17 |
| Hydrogen atoms | 13 |
| Heteroatoms | 4 |
| 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 |
