Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8408070829
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 | 23 USD | 95 | 38 working days | Get Quote |
| 5 mg | 23 USD | 95 | 38 working days | Get Quote |
| 10 mg | 23 USD | 95 | 38 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-8408070829.sdf |
| SMILES | MCULE-8408070829.smiles |
| Standard InChI | MCULE-8408070829.inchi |
| InChIKey | MCULE-8408070829.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867597560 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875757379 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-590373171 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-893565248 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 151.2 g |
| P-436446996 | Alinda | Building Blocks | 95 | As is | 10 g |
| P-606928879 | AmBeed | In stock | N/A | As is | in stock |
| P-489148036 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-875889575 | Angene | Building Blocks in stock | 98 | As is | 25 g |
| P-895958348 | Apollo Scientific | In Stock | 95 | As is | 44 g |
| P-889778828 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-873438439 | BLD pharm | In-stock building blocks | 98 | As is | 15.7 g |
| P-492247489 | ChemBridge | Building Block Library | 95 | As is | in stock |
| P-454754777 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-454693264 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-868624502 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-34835367 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
| P-580764535 | Crea-Chim | Prepacked BB compounds with prompt delivery | 90 | As is | in stock |
| P-580775046 | Crea-Chim | Building Blocks | 90 | As is | by resynthesis (? - ? days) |
| P-580389312 | Debye Scientific | General Catalog | N/A | As is | by resynthesis (? - ? days) |
| P-889111027 | FluoroChem | In Stock BB | N/A | As is | 3 g |
| P-492222965 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-454298691 | Key Organics | Screening Compounds and Fragments | 90 | As is | unavailable |
| P-891668652 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-580492109 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852397347 | Matrix Scientific | All | N/A | As is | in stock |
| P-854832716 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-12914768 | Otava | In-House Stock Library | 90 | As is | 19.94 g |
| P-492284755 | Otava | Chemical Building Blocks for Prompt Delivery | 90 | As is | 19.94 g |
| P-519834195 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-596796482 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-502333728 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-22498282 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 1000 mg |
| P-611571920 | Toronto Research | In stock | 90 | As is | in stock |
| P-578054226 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1000 mg |
| P-596545017 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1000 mg |
| P-893718229 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 164.200 |
| logP | 2.2879 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 4 |
| PSA | 26.3 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 47.9355 |
| Atoms | 24 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 12 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 |
