Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2881241186
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 | 50 USD | 95 | 7 working days | Get Quote |
| 5 mg | 118 USD | 95 | 7 working days | Get Quote |
| 10 mg | 181 USD | 95 | 7 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-2881241186.sdf |
| SMILES | MCULE-2881241186.smiles |
| Standard InChI | MCULE-2881241186.inchi |
| InChIKey | MCULE-2881241186.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867694043 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875873938 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-874639907 | AK Scientific | Building Blocks | N/A | As is | in stock |
| P-903368084 | Aaron Chemicals LLC | Predominantly Building Block | N/A | As is | 200 mg |
| P-904320062 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 10.52 g |
| P-851781576 | AmBeed | On request | N/A | As is | by synthesis |
| P-895110567 | Angene | Building Blocks in stock | 99 | As is | 200 mg |
| P-889795579 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-890233212 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
| P-901563898 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-887182381 | Combi-Blocks | Building Block on demand | N/A | As is | by synthesis |
| P-873250399 | Key Organics | Building Blocks | 97 | As is | 10 mg |
| P-854716707 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-869109880 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-904244386 | TargetMol | In Stock BB | 95 | As is | unavailable |
| P-888628355 | TargetMol | Screening Compounds - stock amount | 95 | As is | 200 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 531.526 |
| logP | 4.8516 |
| H-bond acceptors | 9 |
| H-bond donors | 0 |
| Rotatable bonds | 10 |
| PSA | 89.79 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 139.769 |
| Atoms | 66 |
| Rings | 4 |
| Heavy atoms | 38 |
| Hydrogen atoms | 28 |
| Heteroatoms | 12 |
| N/O atoms | 9 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
