Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4280911835
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 | 45 USD | 90 | 21 working days | Get Quote |
| 5 mg | 72 USD | 90 | 21 working days | Get Quote |
| 10 mg | 86 USD | 90 | 21 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.
-
1
MCULE-1600864687
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-4280911835.sdf |
| SMILES | MCULE-4280911835.smiles |
| Standard InChI | MCULE-4280911835.inchi |
| InChIKey | MCULE-4280911835.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-886690802 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-889992059 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
| P-869249171 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-889835939 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-854877718 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-611544783 | Toronto Research | In stock | 90 | As is | in stock |
| P-893858934 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| P-886656400 | A2B Chem | Predominantly Building Block in stock | N/A | Main component | in stock |
| P-890177468 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-894673273 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-893578157 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | Main component | 32.689 g |
| P-870663923 | AmBeed | On request | N/A | Main component | by synthesis |
| P-873298035 | Angene | Building Blocks in stock | 97 | Main component | 10 g |
| P-895943710 | Apollo Scientific | On request | 95 | Main component | by resynthesis (? - ? days) |
| P-889589697 | AstaTech | In Stock BBs | 95 | Main component | in stock |
| P-870566679 | BLD pharm | Non-stock building blocks | 97 | Main component | by synthesis |
| P-577146866 | ChemDiv | Building Blocks on demand | 90 | Main component | by synthesis |
| P-887186195 | Combi-Blocks | Building Block on demand | 95 | Main component | by synthesis |
| P-575333627 | EvoBlocks | In-stock Building Blocks | 95 | Main component | in stock |
| P-563671684 | Key Organics | Building Blocks | 97 | Main component | 50 mg |
| P-867706390 | Manchester Organics | Compounds on demand | N/A | Main component | by synthesis |
| P-874448304 | MedChemExpress | Building Blocks in stock | 95 | Main component | in stock |
| P-492275684 | Otava | Chemical Building Blocks for Prompt Delivery | 99 | Main component | 16.43 g |
| P-12406648 | Otava | In-House Stock Library | 90 | Main component | 16.43 g |
| P-888896038 | PharmaBlock | In stock | N/A | Main component | in stock |
| P-23544553 | Specs | Screening Compounds | 90 | Main component | 15 mg |
| P-611599505 | Toronto Research | In stock | 90 | Main component | in stock |
| P-886897466 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 246.090 |
| logP | 3.351 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 64.94 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 59.3824 |
| Atoms | 24 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 9 |
| Heteroatoms | 6 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
