Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1556848559
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 | 13 USD | 98 | 14 working days | Get Quote |
| 5 mg | 13 USD | 98 | 14 working days | Get Quote |
| 10 mg | 13 USD | 98 | 14 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-1556848559.sdf |
| SMILES | MCULE-1556848559.smiles |
| Standard InChI | MCULE-1556848559.inchi |
| InChIKey | MCULE-1556848559.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-875747954 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-590415759 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-903078785 | Aaron Chemicals LLC | Predominantly Building Block | 98 | As is | 400 g |
| P-606869543 | AmBeed | In stock | N/A | As is | in stock |
| P-489192525 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596989168 | Angene | Building Blocks in stock | 98 | As is | 400 g |
| P-589660343 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864191643 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-611005155 | BLD pharm | In-stock building blocks | 98 | As is | 31 g |
| P-4201987 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | in stock |
| P-454733770 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-448676602 | ChemDiv | Discovery Chemistry Library | 90 | As is | 1.17 g |
| P-436473535 | Chemical Intelligence Co Limited | Building Blocks | 95 | As is | 5 g |
| P-425203430 | Chemical Intelligence Co Limited | Stock Screening Compounds | 90 | As is | in stock |
| P-868611211 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-580300126 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-889360422 | FluoroChem | General BB | N/A | As is | in stock |
| P-596565254 | Key Organics | Building Blocks | 97 | As is | 1000 mg |
| P-596570422 | Key Organics | Building Blocks | 97 | As is | 1000 mg |
| P-596564978 | Key Organics | Building Blocks | 97 | As is | 5 g |
| P-870639645 | Key Organics | Screening Compounds and Fragments | 97 | As is | 100 mg |
| P-870640253 | Key Organics | Screening Compounds and Fragments | 97 | As is | 100 mg |
| P-870639614 | Key Organics | Screening Compounds and Fragments | 97 | As is | 100 mg |
| P-868742638 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-500405532 | Pi Chemicals | Virtual Compounds | 99 | As is | by synthesis |
| P-885546446 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-903663544 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-888227339 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 7 mg |
| P-611511056 | Toronto Research | In stock | 90 | As is | in stock |
| P-893986942 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-615405157 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 193.199 |
| logP | 1.4551 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 5 |
| PSA | 66.4 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 50.9915 |
| Atoms | 25 |
| Rings | 1 |
| Heavy atoms | 14 |
| Hydrogen atoms | 11 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 |
