Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8662538266-1
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 | 19 USD | 98 | 20 working days | Get Quote |
| 5 mg | 19 USD | 98 | 20 working days | Get Quote |
| 10 mg | 19 USD | 98 | 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.
| Name | File |
|---|---|
| SDF | MCULE-8662538266-1.sdf |
| SMILES | MCULE-8662538266-1.smiles |
| Standard InChI | MCULE-8662538266-1.inchi |
| InChIKey | MCULE-8662538266-1.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-597024210 | AEchem | Building blocks | 95 | As is | in stock |
| P-869195166 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505397811 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-851432776 | AmBeed | On request | N/A | As is | by synthesis |
| P-865911763 | Angene | Building Blocks in stock | 98 | As is | 75 g |
| P-864214932 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-675654177 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
| P-454758689 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-584576077 | ChemDiv | Discovery Chemistry Library | 90 | As is | 278.995 g |
| P-878236033 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868581293 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
| P-34524955 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
| P-580778279 | Crea-Chim | Building Blocks | 90 | As is | by resynthesis (? - ? days) |
| P-580415307 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-489246814 | EvoBlocks | In-stock Building Blocks | 95 | As is | in stock |
| P-428630634 | Eximed | In-stock screening compounds | 90 | As is | in stock |
| P-492273303 | Eximed | Building Block Catalog | 95 | As is | 3.68 g |
| P-861947255 | FluoroChem | General BB | N/A | As is | in stock |
| P-14043332 | InFarmatik | Building Blocks | 90 | As is | no data |
| P-580041916 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-580005836 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-524168446 | Key Organics | Building Blocks | 98 | As is | 1000 mg |
| P-580462461 | Manchester Organics | Compounds on demand | 95 | As is | by synthesis |
| P-852440405 | Matrix Scientific | All | N/A | As is | in stock |
| P-895271602 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-870921510 | Otava | In-House Stock Library | 90 | As is | 3.68 g |
| P-871058641 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 3.68 g |
| P-13506711 | Pharmeks LLC | Synthetic compounds | 92 | As is | 300 mg |
| P-502333431 | TimTec | Building Block Collection | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 218.208 |
| logP | 1.7835 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 75.21 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 57.475 |
| Atoms | 26 |
| Rings | 2 |
| Heavy atoms | 16 |
| 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 |
