Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8509877241-0
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 | 7 USD | 97 | 20 working days | Get Quote |
| 5 mg | 7 USD | 97 | 20 working days | Get Quote |
| 10 mg | 7 USD | 97 | 20 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.
-
MCULE-9871082645-0
- Component type: Main
-
MCULE-5198860634-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-8509877241-0.sdf |
| SMILES | MCULE-8509877241-0.smiles |
| Standard InChI | MCULE-8509877241-0.inchi |
| InChIKey | MCULE-8509877241-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867560847 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-890143286 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-597016178 | AEchem | Building blocks | 98 | As is | in stock |
| P-617063801 | Allbio Pharm | In stock | N/A | As is | in stock |
| P-489139398 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-864126737 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-889739966 | Atlantic Research Chemicals Ltd | In-stock Building Blocks | 95 | As is | 30 g |
| P-619929670 | ChemDiv | Building Blocks on demand | 90 | As is | by synthesis |
| P-868554543 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-580421049 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-890218891 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | As is | in stock |
| P-590341330 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | 14 g |
| P-505491177 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-492217383 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-504609307 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
| P-488548454 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-856042806 | LaboTest | Building Blocks | 90 | As is | unavailable |
| P-31138882 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-613281589 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-895220684 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-12391317 | Otava | In-House Stock Library | 90 | As is | 1.909 g |
| P-492274393 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 1.909 g |
| P-454367478 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-19554054 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-502326501 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611398328 | Toronto Research | In stock | 90 | As is | in stock |
| P-855010097 | Toronto Research | In stock | 90 | As is | in stock |
| P-855010098 | Toronto Research | In stock | 90 | As is | in stock |
| P-480884582 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-867572565 | A2B Chem | Predominantly Building Block in stock | 98 | As a main component | in stock |
| P-867526334 | A2B Chem | Predominantly Building Block on demand | N/A | As a main component | by synthesis |
| P-875732933 | AA Blocks | AA Blocks - in stock | N/A | As a main component | in stock |
| P-588246186 | AK Scientific | Building Blocks | 98 | As a main component | in stock |
| P-893428308 | Advanced ChemBlocks Inc (AChemBlock) | On demand | 90 | As a main component | by synthesis |
| P-580240054 | Aldlab Chemicals | Building Block Custom Synth | 95 | As a main component | by synthesis |
| P-489145953 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As a main component | in stock |
| P-596950061 | Angene | Building Blocks in stock | 97 | As a main component | 300 g |
| P-864229484 | AstaTech | Backordered BBs | 95 | As a main component | by synthesis |
| P-864140482 | AstaTech | In Stock BBs | 98 | As a main component | in stock |
| P-851282289 | Chemshuttle | On request catalog | 95 | As a main component | by synthesis |
| P-580297326 | Debye Scientific | General Catalog | 95 | As a main component | by resynthesis (? - ? days) |
| P-580421051 | Debye Scientific | General Catalog | 95 | As a main component | by resynthesis (? - ? days) |
| P-870657696 | Glentham Life Sciences | Compounds typically in stock | N/A | As a main component | in stock |
| P-505530181 | Hangzhou Apichem | Building Blocks in stock | 95 | As a main component | in stock |
| P-856042807 | LaboTest | Building Blocks | 90 | As a main component | 10 g |
| P-31161513 | LaboTest | Screening Collection | 90 | As a main component | 10 g |
| P-852444188 | Matrix Scientific | All | N/A | As a main component | in stock |
| P-874438181 | MedChemExpress | Building Blocks on demand | 95 | As a main component | by synthesis |
| P-854740501 | MedChemExpress | Building Blocks in stock | 95 | As a main component | in stock |
| P-873281389 | Shanghai iChemical | In stock | N/A | As a main component | in stock |
| P-502328809 | TimTec | Building Block Collection | 90 | As a main component | in stock |
| P-611491667 | Toronto Research | In stock | 90 | As a main component | in stock |
| P-611365842 | Toronto Research | In stock | 90 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 180.222 |
| logP | 1.6291 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 15.27 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 57.7587 |
| Atoms | 26 |
| Rings | 2 |
| Heavy atoms | 13 |
| Hydrogen atoms | 13 |
| Heteroatoms | 3 |
| N/O atoms | 2 |
| 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 |
