Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7844056414
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 | 15 USD | N/A | 9 working days | Get Quote |
| 5 mg | 15 USD | N/A | 9 working days | Get Quote |
| 10 mg | 15 USD | N/A | 9 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-7844056414.sdf |
| SMILES | MCULE-7844056414.smiles |
| Standard InChI | MCULE-7844056414.inchi |
| InChIKey | MCULE-7844056414.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867584301 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875741891 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-590364411 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-903072393 | Aaron Chemicals LLC | Predominantly Building Block | 98 | As is | 10 g |
| P-851580295 | AmBeed | On request | N/A | As is | by synthesis |
| P-873290984 | Angene | Building Blocks in stock | 98 | As is | 25 g |
| P-905466546 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-619593519 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-427957266 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 5 mg |
| P-893361093 | ChemDiv | Pre-weighted stock BB | 90 | As is | 1000 mg |
| P-454630632 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-584543116 | ChemDiv | Discovery Chemistry Library | 90 | As is | 3.695 g |
| P-436468994 | Chemical Intelligence Co Limited | Building Blocks | 95 | As is | in stock |
| P-868617797 | Combi-Blocks | Building Block in stock | N/A | As is | in stock |
| P-502486749 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-488546792 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-13453269 | InterBioScreen | Screening Compounds | 95 | As is | 300 mg |
| P-596592724 | Key Organics | Building Blocks | 90 | As is | 5 g |
| P-31183162 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-588250469 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852448522 | Matrix Scientific | All | N/A | As is | in stock |
| P-854867733 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-454370842 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-885515981 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-18930477 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-896074391 | Specs | Repurposed Compounds | N/A | As is | 551 mg |
| P-596709929 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 1000 mg |
| P-906791466 | Titan Scientific | Predominantly Building Block on demand | 97 | As is | by synthesis |
| P-855228245 | Toronto Research | In stock | 90 | As is | in stock |
| P-449019 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.624 g |
| P-464679265 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1.624 g |
| P-886899978 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 267.075 |
| logP | 3.4073 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 50.44 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 58.8033 |
| Atoms | 22 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 7 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
