Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3577644366
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 | 29 USD | 98 | 20 working days | Get Quote |
| 5 mg | 29 USD | 98 | 20 working days | Get Quote |
| 10 mg | 29 USD | 98 | 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-3577644366.sdf |
| SMILES | MCULE-3577644366.smiles |
| Standard InChI | MCULE-3577644366.inchi |
| InChIKey | MCULE-3577644366.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-875827481 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-584608362 | Alinda | Building Blocks | 95 | As is | 5 g |
| P-606890259 | AmBeed | In stock | N/A | As is | in stock |
| P-873297298 | Angene | Building Blocks in stock | 98 | As is | 65 g |
| P-589662543 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-869392343 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-851145018 | BLD pharm | In-stock building blocks | 98 | As is | 9.5 g |
| P-454690711 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-15159313 | ChemDiv | Discovery Chemistry Library | 90 | As is | 13 mg |
| P-436445283 | Chemical Block | Building Blocks | 90 | As is | 12.69 g |
| P-360853 | Chemical Block | Screening Library | 90 | As is | 350 mg |
| P-868563255 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-868637977 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-34734970 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
| P-889437620 | FluoroChem | General BB | N/A | As is | in stock |
| P-502545985 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-855981415 | Key Organics | Building Blocks | 95 | As is | 1000 mg |
| P-852590932 | Matrix Scientific | All | N/A | As is | in stock |
| P-872527813 | MedChemExpress | In stock Building Blocks | 95 | As is | in stock |
| P-888875986 | PharmaBlock | In stock | N/A | As is | in stock |
| P-24068847 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-491104682 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-873282678 | Shanghai iChemical | In stock | N/A | As is | in stock |
| P-22630935 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-502376175 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-424751358 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 55 mg |
| P-886901190 | eNovation Chemicals LLC | Building Blocks in stock | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 179.605 |
| logP | 2.1251 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 41.57 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 46.8287 |
| Atoms | 18 |
| Rings | 2 |
| Heavy atoms | 12 |
| Hydrogen atoms | 6 |
| 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 |
