Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6590848957
Compound
Show structures
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 | 97 | 8 working days | Get Quote |
| 5 mg | 5 USD | 97 | 8 working days | Get Quote |
| 10 mg | 5 USD | 97 | 8 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-6590848957.sdf |
| SMILES | MCULE-6590848957.smiles |
| Standard InChI | MCULE-6590848957.inchi |
| InChIKey | MCULE-6590848957.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867555521 | A2B Chem | Predominantly Building Block in stock | 97 | As is | in stock |
| P-875714559 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869194337 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505396877 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-580237425 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
| P-19987352 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-436475139 | Alinda | Building Blocks | 95 | As is | in stock |
| P-606882117 | AmBeed | In stock | N/A | As is | in stock |
| P-489183871 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596943232 | Angene | Building Blocks in stock | 97 | As is | 380 g |
| P-494335641 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-596490807 | Asinex | General bb catalog | 90 | As is | 1000 mg |
| P-596388093 | Asinex | General screening catalog | 90 | As is | 1000 mg |
| P-864106971 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-580721693 | BLD pharm | In-stock building blocks | 97 | As is | 28.25 g |
| P-454661093 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-63123 | Chemical Block | Screening Library | 90 | As is | unavailable |
| P-878235816 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868594291 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-34741676 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
| P-580433448 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-889111056 | FluoroChem | In Stock BB | N/A | As is | 23 g |
| P-588281452 | Georganics Ltd. | In stock | 97 | As is | in stock |
| P-890210985 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | As is | in stock |
| P-579522142 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | in stock |
| P-18819780 | Key Organics | Screening Compounds and Fragments | 90 | As is | 103 mg |
| P-615646378 | LabNetwork | In stock | 95 | As is | in stock |
| P-580515108 | Manchester Organics | Stock compounds | 97 | As is | 7 g |
| P-852386134 | Matrix Scientific | All | N/A | As is | in stock |
| P-854732120 | MedChemExpress | In stock Building Blocks | 95 | As is | in stock |
| P-617692202 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 1.096 g |
| P-26432845 | Otava | In-House Stock Library | 90 | As is | 1.096 g |
| P-888888932 | PharmaBlock | In stock | N/A | As is | in stock |
| P-500384558 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-19253045 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-859988590 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-596779305 | Synthonix | In-stock Building Blocks | 95 | As is | 723.75 g |
| P-502330340 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-22522395 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 8 mg |
| P-611433973 | Toronto Research | In stock | 90 | As is | in stock |
| P-424663122 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.581 g |
| P-615397650 | eNovation Chemicals LLC | Building Blocks in stock | 97 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 126.110 |
| logP | 1.2862 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 50.44 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 30.6333 |
| Atoms | 15 |
| Rings | 1 |
| Heavy atoms | 9 |
| Hydrogen atoms | 6 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 |
