Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5564514374
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 | 36 USD | 95 | 14 working days | Get Quote |
| 5 mg | 36 USD | 95 | 14 working days | Get Quote |
| 10 mg | 41 USD | 95 | 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-5564514374.sdf |
| SMILES | MCULE-5564514374.smiles |
| Standard InChI | MCULE-5564514374.inchi |
| InChIKey | MCULE-5564514374.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-852108403 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
| P-901203476 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
| P-615724151 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-436463894 | Alinda | Building Blocks | 95 | As is | 6 g |
| P-19865901 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-851703020 | AmBeed | On request | N/A | As is | by synthesis |
| P-489202196 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-864273379 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-590898221 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-577174593 | ChemDiv | Building Blocks on demand | 90 | As is | by synthesis |
| P-5098246 | ChemDiv | Discovery Chemistry Library | 90 | As is | 24 mg |
| P-250529 | Chemical Block | Screening Library | 90 | As is | 820 mg |
| P-861505898 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-34595849 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
| P-502467337 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-504282631 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
| P-502677902 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-492227792 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-13289775 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
| P-855975011 | Key Organics | Building Blocks | 95 | As is | 1000 mg |
| P-852434377 | Matrix Scientific | All | N/A | As is | in stock |
| P-854920778 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-19101661 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-491181476 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-33444362 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-502387733 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-888431381 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-611592790 | Toronto Research | In stock | 90 | As is | in stock |
| P-3238827 | VITAS M CHEMICAL LIMITED | Collections of Fragments for Fragment-based Drug Discovery | 90 | As is | 2.355 g |
| P-886940333 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 199.212 |
| logP | 1.7493 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 69.1 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 57.6584 |
| Atoms | 24 |
| Rings | 3 |
| Heavy atoms | 15 |
| Hydrogen atoms | 9 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| 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 |
