Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9579462655
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 | 95 | 10 working days | Get Quote |
| 5 mg | 5 USD | 95 | 10 working days | Get Quote |
| 10 mg | 5 USD | 95 | 10 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-9579462655.sdf |
| SMILES | MCULE-9579462655.smiles |
| Standard InChI | MCULE-9579462655.inchi |
| InChIKey | MCULE-9579462655.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867611443 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875771363 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-535625616 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505354175 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-580198502 | Aldlab Chemicals | Building Block Stock | 95 | As is | 25 g |
| P-517098367 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-606946569 | AmBeed | In stock | N/A | As is | in stock |
| P-489139586 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596962747 | Angene | Building Blocks in stock | 98 | As is | 3.39 kg |
| P-494349858 | Apollo Scientific | In Stock | 95 | As is | in stock |
| P-864089346 | AstaTech | In Stock BBs | 97 | As is | in stock |
| P-851240865 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-861280888 | Chiralstar | Chiralstar Building Blocks | 97 | As is | in stock |
| P-868555114 | Combi-Blocks | Building Block in stock | 96 | As is | in stock |
| P-580431976 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-889113879 | FluoroChem | In Stock BB | N/A | As is | 100 g |
| P-505534995 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-890849977 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-890850772 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-502528343 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-454416898 | Key Organics | Building Blocks | 95 | As is | 139 mg |
| P-454351585 | Key Organics | Screening Compounds and Fragments | 95 | As is | 139 mg |
| P-579613419 | LabSeeker, Inc | Stock Collection | 97 | As is | in stock |
| P-580502926 | Manchester Organics | Compounds on demand | 98 | As is | by synthesis |
| P-852442107 | Matrix Scientific | All | N/A | As is | in stock |
| P-854736118 | MedChemExpress | In stock Building Blocks | 95 | As is | in stock |
| P-620056617 | Otava | In-House Stock Library | 90 | As is | 1000 mg |
| P-620222833 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 1000 mg |
| P-888867063 | PharmaBlock | In stock | N/A | As is | in stock |
| P-885548811 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-596742676 | Synthonix | In-stock Building Blocks | 97 | As is | 1.511 kg |
| P-502363179 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-33181833 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 4 mg |
| P-611369156 | Toronto Research | In stock | 90 | As is | in stock |
| P-615395240 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 218.005 |
| logP | 2.5861 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 66.05 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 44.987 |
| Atoms | 15 |
| Rings | 1 |
| Heavy atoms | 11 |
| Hydrogen atoms | 4 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| 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 |
