Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6967691364
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 | 18 USD | 95 | 19 working days | Get Quote |
| 5 mg | 18 USD | 95 | 19 working days | Get Quote |
| 10 mg | 18 USD | 95 | 19 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-6967691364.sdf |
| SMILES | MCULE-6967691364.smiles |
| Standard InChI | MCULE-6967691364.inchi |
| InChIKey | MCULE-6967691364.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867626643 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875789801 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-881672372 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505392994 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-610975695 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 296.45 g |
| P-851766000 | AmBeed | On request | N/A | As is | by synthesis |
| P-489130385 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-597003894 | Angene | Building Blocks in stock | 97 | As is | 30 g |
| P-494320029 | Apollo Scientific | In Stock | 95 | As is | in stock |
| P-864161744 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-591073059 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
| P-861411917 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-861920856 | FluoroChem | General BB | N/A | As is | in stock |
| P-505492508 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-563497493 | Key Organics | Building Blocks | 95 | As is | 991 mg |
| P-524193959 | Key Organics | Building Blocks | 97 | As is | 5 g |
| P-855996934 | Key Organics | Screening Compounds and Fragments | 97 | As is | 100 mg |
| P-862384780 | Key Organics | Screening Compounds and Fragments | 95 | As is | 991 mg |
| P-454330033 | Key Organics | Screening Compounds and Fragments | 90 | As is | 87 mg |
| P-852377716 | Matrix Scientific | All | N/A | As is | in stock |
| P-888873275 | PharmaBlock | In stock | N/A | As is | in stock |
| P-500391850 | Pi Chemicals | Virtual Compounds | 97 | As is | by synthesis |
| P-889871315 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-502326661 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-22468797 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 50 mg |
| P-611370007 | Toronto Research | In stock | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 201.170 |
| logP | 1.6195 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 63.32 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 45.4172 |
| Atoms | 23 |
| Rings | 1 |
| Heavy atoms | 14 |
| Hydrogen atoms | 9 |
| Heteroatoms | 5 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
