Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2916221203-0
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 | 30 USD | 95 | 12 working days | Get Quote |
| 5 mg | 30 USD | 95 | 12 working days | Get Quote |
| 10 mg | 30 USD | 95 | 12 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-8755515854-0
- Component type: Main
-
MCULE-4380865067-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-2916221203-0.sdf |
| SMILES | MCULE-2916221203-0.smiles |
| Standard InChI | MCULE-2916221203-0.inchi |
| InChIKey | MCULE-2916221203-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867457917 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-851604675 | AmBeed | On request | N/A | As is | by synthesis |
| P-489245384 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-590921988 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-861398322 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-895515588 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-611579753 | Toronto Research | In stock | 90 | As is | in stock |
| P-867636255 | A2B Chem | Predominantly Building Block in stock | 97 | As a main component | in stock |
| P-875800967 | AA Blocks | AA Blocks - in stock | N/A | As a main component | in stock |
| P-615712801 | AK Scientific | Building Blocks | 95 | As a main component | in stock |
| P-899933207 | AmBeed | On request | N/A | As a main component | by synthesis |
| P-851942285 | AmBeed | In stock | N/A | As a main component | in stock |
| P-865921055 | Angene | Building Blocks in stock | 97 | As a main component | 81.4 g |
| P-864206974 | AstaTech | In Stock BBs | 95 | As a main component | in stock |
| P-616205653 | BLD pharm | In-stock building blocks | 97 | As a main component | 1000 mg |
| P-4148769 | ChemBridge | EXPRESS-Pick Collection | 90 | As a main component | 100 mg |
| P-861278415 | Chiralstar | Chiralstar Building Blocks | 95 | As a main component | in stock |
| P-870581294 | Combi-Blocks | Building Block in stock | 97 | As a main component | in stock |
| P-862058322 | FluoroChem | General BB | 95 | As a main component | in stock |
| P-855962831 | Key Organics | Building Blocks | 97 | As a main component | 250 mg |
| P-615656050 | LabNetwork | In stock | 95 | As a main component | in stock |
| P-852395688 | Matrix Scientific | All | N/A | As a main component | in stock |
| P-854799854 | MedChemExpress | Building Blocks on demand | 95 | As a main component | by synthesis |
| P-895703616 | MedChemExpress | Building Blocks on demand | 95 | As a main component | by synthesis |
| P-675100812 | Princeton Biomolecular Research | Screening Compounds | 90 | As a main component | in stock |
| P-617607150 | Specs | Screening Compounds | 90 | As a main component | 258 mg |
| P-502385436 | TimTec | Building Block Collection | 90 | As a main component | in stock |
| P-611602983 | Toronto Research | In stock | 90 | As a main component | in stock |
| P-868513711 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 179.258 |
| logP | 3.0229 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 35.25 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 55.0284 |
| Atoms | 30 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 17 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
