Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1643630195-0
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 | 36 USD | 95 | 10 working days | Get Quote |
| 5 mg | 36 USD | 95 | 10 working days | Get Quote |
| 10 mg | 36 USD | 95 | 10 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-5424856718-0
- Component type: Main
-
2
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1643630195-0.sdf |
| SMILES | MCULE-1643630195-0.smiles |
| Standard InChI | MCULE-1643630195-0.inchi |
| InChIKey | MCULE-1643630195-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867408099 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-617652672 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-619826096 | ChemDiv | Discovery Chemistry Library | 90 | As is | 23 mg |
| P-278333156 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
| P-580772319 | Crea-Chim | Prepacked BB compounds with prompt delivery | 90 | As is | in stock |
| P-580784976 | Crea-Chim | Building Blocks | 90 | As is | by resynthesis (? - ? days) |
| P-580502196 | Manchester Organics | Compounds on demand | 95 | As is | by synthesis |
| P-852608669 | Matrix Scientific | All | N/A | As is | in stock |
| P-867535312 | A2B Chem | Predominantly Building Block in stock | 96 | Main component | in stock |
| P-875690400 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-890251703 | ACS Scientific | Synthesis catalog | 97 | Main component | by synthesis |
| P-590398669 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-903011345 | Aaron Chemicals LLC | Predominantly Building Block | 97 | Main component | 5 g |
| P-893490305 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | Main component | 26.4 g |
| P-580242792 | Aldlab Chemicals | Building Block Custom Synth | 95 | Main component | by synthesis |
| P-436453354 | Alinda | Building Blocks | 95 | Main component | 30 g |
| P-888933308 | AmBeed | On request | N/A | Main component | by synthesis |
| P-489220010 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | Main component | in stock |
| P-865902135 | Angene | Building Blocks in stock | 97 | Main component | 5 g |
| P-494349327 | Apollo Scientific | In Stock | 95 | Main component | 500 mg |
| P-596497411 | Asinex | General bb catalog | 90 | Main component | 1000 mg |
| P-596454256 | Asinex | General screening catalog | 90 | Main component | 1000 mg |
| P-864103318 | AstaTech | In Stock BBs | 95 | Main component | in stock |
| P-454715649 | ChemDiv | Building Blocks in stock | 90 | Main component | in stock |
| P-851265236 | Chemshuttle | On request catalog | 95 | Main component | by synthesis |
| P-868596075 | Combi-Blocks | Building Block in stock | 95 | Main component | in stock |
| P-861959428 | FluoroChem | General BB | N/A | Main component | in stock |
| P-590341688 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | Main component | 15 g |
| P-890219223 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | Main component | in stock |
| P-454343729 | Key Organics | Screening Compounds and Fragments | 90 | Main component | 100 mg |
| P-579680995 | LabSeeker, Inc | On demand Catalog | 95 | Main component | by resynthesis (? - ? days) |
| P-580485260 | Manchester Organics | Compounds on demand | N/A | Main component | by synthesis |
| P-852388588 | Matrix Scientific | All | N/A | Main component | in stock |
| P-895264639 | MedChemExpress | Building Blocks on demand | 95 | Main component | by synthesis |
| P-888878189 | PharmaBlock | In stock | N/A | Main component | in stock |
| P-888666010 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
| P-33467310 | TimTec | ActiMol 3 Week | 90 | Main component | in stock |
| P-502344477 | TimTec | Building Block Collection | 90 | Main component | in stock |
| P-903660543 | TimTec | ActiMol 4 Week - On demand | 94 | Main component | by resynthesis (? - ? days) |
| P-611396900 | Toronto Research | In stock | 90 | Main component | in stock |
| P-863616867 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | Main component | 105 mg |
| P-481010134 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 249.177 |
| logP | 4.1148 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 29.26 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 72.6874 |
| Atoms | 33 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 18 |
| 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 |
