Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6720694748
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 | 11 USD | 98 | 20 working days | Get Quote |
| 5 mg | 11 USD | 98 | 20 working days | Get Quote |
| 10 mg | 11 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-6720694748.sdf |
| SMILES | MCULE-6720694748.smiles |
| Standard InChI | MCULE-6720694748.inchi |
| InChIKey | MCULE-6720694748.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867583615 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875741710 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869193307 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-579760818 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-19867523 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-606898966 | AmBeed | In stock | N/A | As is | in stock |
| P-489107082 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596953234 | Angene | Building Blocks in stock | 98 | As is | 100 g |
| P-494328421 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864183740 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-481174086 | Atlantic Research Chemicals Ltd | In-stock Building Blocks | 95 | As is | 412 g |
| P-584628086 | BLD pharm | In-stock building blocks | 98 | As is | 147 g |
| P-10554261 | ChemDiv | Discovery Chemistry Library | 90 | As is | 2 mg |
| P-868614660 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-34777881 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
| P-580403275 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-896533768 | FluoroChem | In Stock BB | N/A | As is | 1000 mg |
| P-454384135 | Key Organics | Building Blocks | 95 | As is | 29.838 g |
| P-18809958 | Key Organics | Screening Compounds and Fragments | 95 | As is | 29.838 g |
| P-579661673 | LabSeeker, Inc | On demand Catalog | 97 | As is | by resynthesis (? - ? days) |
| P-852415243 | Matrix Scientific | All | N/A | As is | in stock |
| P-428008927 | Maybridge | Screening Collection | 90 | As is | 4.721 kg |
| P-901006362 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-578150659 | Otava | In-House Stock Library | 90 | As is | 53 mg |
| P-500402974 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-18940519 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-889867229 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-596748155 | Synthonix | In-stock Building Blocks | 98 | As is | 423 g |
| P-502363598 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-22486926 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 80 mg |
| P-611408941 | Toronto Research | In stock | 90 | As is | in stock |
| P-3245906 | VITAS M CHEMICAL LIMITED | Collections of Fragments for Fragment-based Drug Discovery | 90 | As is | 276 mg |
| P-886924317 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 177.242 |
| logP | 2.7833 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 43.09 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 53.8069 |
| Atoms | 28 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 15 |
| 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 |
