Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4973809689
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 | 35 USD | 95 | 14 working days | Get Quote |
| 5 mg | 35 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-4973809689.sdf |
| SMILES | MCULE-4973809689.smiles |
| Standard InChI | MCULE-4973809689.inchi |
| InChIKey | MCULE-4973809689.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-886582525 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-889913601 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
| P-613845970 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-517167808 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-436451586 | Alinda | Building Blocks | 95 | As is | 46 g |
| P-851717311 | AmBeed | On request | N/A | As is | by synthesis |
| P-889808380 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-619928836 | ChemDiv | Building Blocks on demand | 90 | As is | by synthesis |
| P-4933054 | ChemDiv | Discovery Chemistry Library | 90 | As is | 22 mg |
| P-437 | Chemical Block | Building Blocks | 90 | As is | 389 g |
| P-107577 | Chemical Block | Screening Library | 90 | As is | 823 mg |
| P-868633731 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
| P-34778483 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
| P-580776195 | Crea-Chim | Building Blocks | 95 | As is | by resynthesis (? - ? days) |
| P-580442954 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-861931809 | FluoroChem | General BB | N/A | As is | in stock |
| P-588280908 | Georganics Ltd. | In stock | 97 | As is | in stock |
| P-492227562 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-502762369 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-502502807 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-503472880 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
| P-855971389 | Key Organics | Building Blocks | 95 | As is | 1000 mg |
| P-580476936 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852405945 | Matrix Scientific | All | N/A | As is | in stock |
| P-35289809 | Maybridge | Screening Collection | 90 | As is | 21.201 kg |
| P-854917898 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-12805149 | Otava | In-House Stock Library | 90 | As is | 1.72 g |
| P-492283132 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 1.72 g |
| P-18830006 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-491128713 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-502326723 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-22469632 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 141 mg |
| P-611377225 | Toronto Research | In stock | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 207.611 |
| logP | 1.8344 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 1 |
| PSA | 37.38 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 56.02 |
| Atoms | 20 |
| Rings | 2 |
| Heavy atoms | 14 |
| 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 |
