Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8587144313-1
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 | 5 USD | 99 | 9 working days | Get Quote |
| 5 mg | 5 USD | 99 | 9 working days | Get Quote |
| 10 mg | 5 USD | 99 | 9 working days | Get Quote |
New customers are eligible for 10% discount if indicated at the time of ordering.
- 1-Click Docking Predict the binding orientation and affinity of the ligand to a target.
- 1-Click Scaffold Hop Find novel active ligands structurally different from the ligand.
- 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.
-
MCULE-7007482346-0
- Component type: Main
-
MCULE-2773521709-0
- Component type: Main
-
MCULE-8344520452-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-8587144313-1.sdf |
| SMILES | MCULE-8587144313-1.smiles |
| Standard InChI | MCULE-8587144313-1.inchi |
| InChIKey | MCULE-8587144313-1.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability | Updated |
|---|---|---|---|---|---|---|
| P-505388841 | AK Scientific | Building Blocks | 98 | As a main component | in stock | July 13, 2018 |
| P-505353266 | AK Scientific | Building Blocks | 97 | As a main component | in stock | July 13, 2018 |
| P-869187129 | AK Scientific | Building Blocks | 95 | As a main component | in stock | December 6, 2022 |
| P-869194568 | AK Scientific | Building Blocks | 95 | As a main component | in stock | December 6, 2022 |
| P-617061167 | Allbio Pharm | In stock | 97 | As a main component | in stock | January 22, 2021 |
| P-851937111 | AmBeed | In stock | N/A | As a main component | in stock | April 1, 2022 |
| P-489142946 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As a main component | in stock | December 20, 2016 |
| P-489175925 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As a main component | in stock | December 20, 2016 |
| P-596987331 | Angene | Building Blocks in stock | 97 | As a main component | 20 g | April 27 |
| P-596984542 | Angene | Building Blocks in stock | 99 | As a main component | 1000 g | April 27 |
| P-596659492 | Apollo Scientific | In Stock | 95 | As a main component | in stock | June 7, 2022 |
| P-864146315 | AstaTech | In Stock BBs | 98 | As a main component | in stock | April 26, 2022 |
| P-590860698 | BLD pharm | Non-stock building blocks | 98 | As a main component | by synthesis | May 4 |
| P-615697798 | BLD pharm | In-stock building blocks | 99 | As a main component | 4.525 kg | May 18 |
| P-590621691 | BLD pharm | In-stock building blocks | 99 | As a main component | 89.65 kg | May 18 |
| P-868591502 | Combi-Blocks | Building Block in stock | 96 | As a main component | in stock | October 7, 2022 |
| P-868592734 | Combi-Blocks | Building Block in stock | 98 | As a main component | in stock | October 7, 2022 |
| P-861976009 | FluoroChem | All BB | 99 | As a main component | in stock | May 5, 2022 |
| P-862138980 | FluoroChem | All BB | 98 | As a main component | in stock | May 5, 2022 |
| P-500418107 | Glentham Life Sciences | Compounds maintained in stock | 99 | As a main component | in stock | June 11, 2022 |
| P-870661904 | Glentham Life Sciences | Compounds typically in stock | 99 | As a main component | in stock | February 3 |
| P-596572324 | Key Organics | Building Blocks | 97 | As a main component | 5 g | Yesterday |
| P-855397210 | MedChemExpress | In stock Building Blocks | 95 | As a main component | in stock | June 6, 2022 |
| P-872680322 | MedKoo | In stock compounds | 95 | As a main component | in stock | February 27 |
| P-619673971 | Molnova | Stock | 98 | As a main component | in stock | November 16, 2020 |
| P-500380522 | Pi Chemicals | Virtual Compounds | 99 | As a main component | by synthesis | August 8, 2017 |
| P-500380524 | Pi Chemicals | Virtual Compounds | 98 | As a main component | by synthesis | August 8, 2017 |
| P-869163168 | TargetMol | Screening Compounds | 95 | As a main component | 97.775 g | March 1 |
| P-611401857 | Toronto Research | In stock | 90 | As a main component | in stock | June 25, 2020 |
| P-611407753 | Toronto Research | In stock | 90 | As a main component | in stock | June 25, 2020 |
| P-580085768 | eNovation Chemicals LLC | Building Blocks in stock | 97 | As a main component | in stock | January 22, 2019 |
| P-666976534 | eNovation Chemicals LLC | Building Blocks in stock | 99 | As a main component | in stock | October 28, 2021 |
| P-868536427 | eNovation Chemicals LLC | Building Blocks in stock | 98 | As a main component | in stock | October 11, 2022 |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 87.054 |
| logP | -1.6747 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 1 |
| PSA | 57.2 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 16.5645 |
| Atoms | 9 |
| Rings | 0 |
| Heavy atoms | 6 |
| Hydrogen atoms | 3 |
| 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 |
