Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8449557554
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 | 31 USD | 99 | 19 working days | Get Quote |
| 5 mg | 31 USD | 99 | 19 working days | Get Quote |
| 10 mg | 31 USD | 99 | 19 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.
-
MCULE-9706777749
- Component type: Unknown
| Name | File |
|---|---|
| SDF | MCULE-8449557554.sdf |
| SMILES | MCULE-8449557554.smiles |
| Standard InChI | MCULE-8449557554.inchi |
| InChIKey | MCULE-8449557554.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867667737 | A2B Chem | Predominantly Building Block in stock | 99 | As is | in stock |
| P-875835869 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869189699 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-869279708 | AK Scientific | Building Blocks | 99 | As is | in stock |
| P-588247435 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-893606213 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 500 mg |
| P-861306747 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-489188924 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-864174862 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-893262789 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-619292763 | ChemDiv | Discovery Chemistry Library | 90 | As is | 1 mg |
| P-288216 | Chemical Block | Screening Library | 90 | As is | 1 mg |
| P-861338812 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-502532476 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-492242140 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-855920783 | Key Organics | Building Blocks | 97 | As is | 25 g |
| P-872528925 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-896628588 | MedChemExpress | Screening compounds on demand | 95 | As is | by synthesis |
| P-888173741 | Molnova | On demand | 98 | As is | by synthesis |
| P-500401083 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-19039300 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-869124706 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892290459 | TargetMol | In Stock BB | 95 | As is | unavailable |
| P-888638423 | TargetMol | Screening Compounds - stock amount | 95 | As is | 193 mg |
| P-888450057 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-590419608 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-892944001 | A2B Chem | Predominantly Building Block on demand | N/A | As a component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 241.359 |
| logP | 2.3801 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 5 |
| PSA | 88.03 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 69.3874 |
| Atoms | 35 |
| Rings | 1 |
| Heavy atoms | 16 |
| Hydrogen atoms | 19 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| 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 |
