Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8876094473
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 | 13 USD | 98 | 20 working days | Get Quote |
| 5 mg | 13 USD | 98 | 20 working days | Get Quote |
| 10 mg | 13 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-8876094473.sdf |
| SMILES | MCULE-8876094473.smiles |
| Standard InChI | MCULE-8876094473.inchi |
| InChIKey | MCULE-8876094473.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867635839 | A2B Chem | Predominantly Building Block in stock | 96 | As is | in stock |
| P-875801460 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-505349690 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-869342670 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-610980418 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 56.23 g |
| P-866099229 | Advanced Chemical Intermediates (ACI) | ACI predominantly BB catalog | 95 | As is | unavailable |
| P-606926371 | AmBeed | In stock | N/A | As is | in stock |
| P-489115697 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-597009668 | Angene | Building Blocks in stock | 98 | As is | 25 g |
| P-494330063 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-596423838 | Asinex | General screening catalog | 90 | As is | 1000 mg |
| P-596515275 | Asinex | General bb catalog | 90 | As is | 1000 mg |
| P-864092686 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-605421675 | BLD pharm | In-stock building blocks | 96 | As is | 8.25 g |
| P-868580686 | Combi-Blocks | Building Block in stock | 96 | As is | in stock |
| P-580301007 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-579719541 | EDASA Scientific Limited | Synthesis Building Blocks | N/A | As is | by resynthesis (? - ? days) |
| P-896531698 | FluoroChem | In Stock BB | N/A | As is | 10 g |
| P-502505943 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-454376767 | Key Organics | Building Blocks | 95 | As is | 17.775 g |
| P-18683158 | Key Organics | Screening Compounds and Fragments | 95 | As is | 17.775 g |
| P-468070427 | Life Chemicals | Building Blocks | 95 | As is | 2.407 g |
| P-14819102 | Life Chemicals | Screening Compounds | 90 | As is | 2.407 g |
| P-852386314 | Matrix Scientific | All | N/A | As is | in stock |
| P-854744738 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-500399894 | Pi Chemicals | Virtual Compounds | 95 | As is | by synthesis |
| P-889868876 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-535646811 | Rieke Metals | Natural Compounds | N/A | As is | in stock |
| P-896079824 | Specs | Repurposed Compounds | N/A | As is | 7 mg |
| P-502333946 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-615405963 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 212.243 |
| logP | 3.1747 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 3 |
| PSA | 26.3 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 63.7575 |
| Atoms | 28 |
| Rings | 2 |
| Heavy atoms | 16 |
| Hydrogen atoms | 12 |
| 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 |
