Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8444270017
Compound
Show structures
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 | 19 USD | 92 | 18 working days | Get Quote |
| 5 mg | 25 USD | 97 | 20 working days | Get Quote |
| 10 mg | 25 USD | 97 | 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-8444270017.sdf |
| SMILES | MCULE-8444270017.smiles |
| Standard InChI | MCULE-8444270017.inchi |
| InChIKey | MCULE-8444270017.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867655064 | A2B Chem | Predominantly Building Block in stock | 97 | As is | in stock |
| P-875823081 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-612939925 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-903186113 | Aaron Chemicals LLC | Predominantly Building Block | 97 | As is | 25 g |
| P-893514903 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 30 g |
| P-606935817 | AmBeed | In stock | N/A | As is | in stock |
| P-865924913 | Angene | Building Blocks in stock | 97 | As is | 25 g |
| P-864085299 | AstaTech | In Stock BBs | 97 | As is | in stock |
| P-674402465 | BLD pharm | In-stock building blocks | 97 | As is | 8.77 g |
| P-3872756 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 1 mg |
| P-619933680 | ChemDiv | Building Blocks on demand | 90 | As is | by synthesis |
| P-619302793 | ChemDiv | Discovery Chemistry Library | 90 | As is | unavailable |
| P-436445112 | Chemical Block | Building Blocks | 90 | As is | 8.799 g |
| P-357575 | Chemical Block | Screening Library | 90 | As is | 237 mg |
| P-436462111 | Chemical Intelligence Co Limited | Building Blocks | 95 | As is | in stock |
| P-861552186 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-34734183 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
| P-579799456 | Eximed | In-stock screening compounds | 90 | As is | in stock |
| P-428593763 | Eximed | In-stock screening compounds | 90 | As is | in stock |
| P-569433815 | Eximed | Building Block Catalog | 95 | As is | 1.02 g |
| P-862034516 | FluoroChem | General BB | N/A | As is | in stock |
| P-675217432 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-502504403 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-504595020 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
| P-502936328 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-492228549 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-488551757 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-13765054 | InterBioScreen | Screening Compounds | 95 | As is | 300 mg |
| P-563393046 | Key Organics | Building Blocks | 97 | As is | 250 mg |
| P-580495119 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852433023 | Matrix Scientific | All | N/A | As is | in stock |
| P-854829477 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-492279518 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 1.02 g |
| P-34030318 | Otava | In-House Stock Library | 90 | As is | 1.02 g |
| P-454372547 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-445289340 | Pharmeks LLC | Synthetic compounds | 92 | As is | 300 mg |
| P-856067451 | Princeton Biomolecular Research | Building Block Stock | 95 | As is | 1.02 g |
| P-19645927 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-33454174 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-502359660 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611486233 | Toronto Research | In stock | 90 | As is | in stock |
| P-464685211 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1.036 g |
| P-2648157 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.036 g |
| P-868512327 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 201.224 |
| logP | 2.3156 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 61.03 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 58.3644 |
| Atoms | 26 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 11 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 |
