Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9622360798
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 | 22 working days | Get Quote |
| 5 mg | 5 USD | 98 | 22 working days | Get Quote |
| 10 mg | 5 USD | 98 | 22 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-9622360798.sdf |
| SMILES | MCULE-9622360798.smiles |
| Standard InChI | MCULE-9622360798.inchi |
| InChIKey | MCULE-9622360798.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867583836 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875741759 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-597024082 | AEchem | Building blocks | 98 | As is | in stock |
| P-893571058 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 782.622 g |
| P-580260484 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
| P-606919185 | AmBeed | In stock | N/A | As is | in stock |
| P-489128233 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596953249 | Angene | Building Blocks in stock | 98 | As is | 477.75 g |
| P-494349223 | Apollo Scientific | In Stock | 95 | As is | in stock |
| P-864116094 | AstaTech | In Stock BBs | 97 | As is | in stock |
| P-851257163 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-851271764 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868572390 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-580407172 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-881675438 | EDASA Scientific Limited | Synthesis Building Blocks | N/A | As is | by resynthesis (? - ? days) |
| P-889112880 | FluoroChem | In Stock BB | N/A | As is | 5 g |
| P-524168386 | Key Organics | Building Blocks | 98 | As is | 100 mg |
| P-855993325 | Key Organics | Screening Compounds and Fragments | 98 | As is | 100 mg |
| P-579664837 | LabSeeker, Inc | On demand Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-580485705 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852529219 | Matrix Scientific | All | N/A | As is | in stock |
| P-865620226 | MedChemExpress | In stock Building Blocks | 95 | As is | in stock |
| P-26525342 | Otava | In-House Stock Library | 90 | As is | 90 mg |
| P-500387989 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-885544276 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-873285322 | Shanghai iChemical | In stock | N/A | As is | in stock |
| P-596756001 | Synthonix | In-stock Building Blocks | 98 | As is | 588.5 g |
| P-615397099 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 209.627 |
| logP | 1.7407 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 46.17 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 56.7252 |
| Atoms | 22 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 8 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
