Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8091178078
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 | 5 USD | 98 | 9 working days | Get Quote |
| 5 mg | 5 USD | 98 | 9 working days | Get Quote |
| 10 mg | 5 USD | 98 | 9 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-8091178078.sdf |
| SMILES | MCULE-8091178078.smiles |
| Standard InChI | MCULE-8091178078.inchi |
| InChIKey | MCULE-8091178078.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867586774 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875745365 | AA Blocks | AA Blocks | N/A | As is | in stock |
| P-869186421 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-588245961 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-580247703 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
| P-606919311 | AmBeed | In stock | N/A | As is | in stock |
| P-489190442 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596954611 | Angene | Building Blocks in stock | 98 | As is | 2.20031 kg |
| P-864154406 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-580697322 | BLD pharm | In-stock building blocks | 98 | As is | 150 g |
| P-452655841 | Chemfaces | Natural Compounds | 98 | As is | in stock |
| P-868619741 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-579477668 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
| P-580304147 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-862017196 | FluoroChem | General BB | N/A | As is | in stock |
| P-675211380 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-492242981 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-856010001 | Key Organics | Biochemicals | 98 | As is | 100 mg |
| P-31274655 | LaboTest | Screening Collection | 90 | As is | 10 g |
| P-856043438 | LaboTest | Building Blocks | 90 | As is | 10 g |
| P-675208276 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-852460990 | Matrix Scientific | All | N/A | As is | in stock |
| P-854691358 | MedChemExpress | Natural Products In stock | 95 | As is | in stock |
| P-878641791 | Molnova | Stock | 98 | As is | in stock |
| P-885535791 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-617403015 | Selleckchem | Product Catalog | N/A | As is | in stock |
| P-869176711 | TargetMol | Natural Products | 95 | As is | 19.646 g |
| P-502368385 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-33163655 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 500 mg |
| P-480883997 | eNovation Chemicals LLC | Building Blocks in stock | 97 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 198.172 |
| logP | 0.9801 |
| H-bond acceptors | 5 |
| H-bond donors | 3 |
| Rotatable bonds | 3 |
| PSA | 86.99 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 48.5975 |
| Atoms | 24 |
| Rings | 1 |
| Heavy atoms | 14 |
| Hydrogen atoms | 10 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| 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 |
