Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5751107465
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 | 8 USD | 97 | 20 working days | Get Quote |
| 5 mg | 8 USD | 97 | 20 working days | Get Quote |
| 10 mg | 8 USD | 97 | 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-5751107465.sdf |
| SMILES | MCULE-5751107465.smiles |
| Standard InChI | MCULE-5751107465.inchi |
| InChIKey | MCULE-5751107465.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867659770 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875828591 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869182247 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505390766 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-874618954 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-610984458 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 335.474 g |
| P-580239778 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
| P-606890282 | AmBeed | In stock | N/A | As is | in stock |
| P-489172686 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596972107 | Angene | Building Blocks in stock | 97 | As is | 100 g |
| P-892404087 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
| P-893259249 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-580402171 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-505522297 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-596600392 | Key Organics | Building Blocks | 97 | As is | 5 g |
| P-454386508 | Key Organics | Building Blocks | 95 | As is | 100 g |
| P-855913823 | Key Organics | Building Blocks | 97 | As is | 5 g |
| P-454288229 | Key Organics | Screening Compounds and Fragments | 95 | As is | 100 mg |
| P-852488843 | Matrix Scientific | All | N/A | As is | in stock |
| P-865620825 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-871072714 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-424125833 | Otava | In-House Stock Library | 90 | As is | 175 mg |
| P-500405864 | Pi Chemicals | Virtual Compounds | 97 | As is | by synthesis |
| P-19261045 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-889871383 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-869124993 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-888638660 | TargetMol | Screening Compounds - stock amount | 95 | As is | unavailable |
| P-22895769 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-611518371 | Toronto Research | In stock | 90 | As is | in stock |
| P-3240701 | VITAS M CHEMICAL LIMITED | Collections of Fragments for Fragment-based Drug Discovery | 90 | As is | 3.515 g |
| P-590430276 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 163.173 |
| logP | 0.4099 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 46.17 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 45.6777 |
| Atoms | 21 |
| Rings | 3 |
| Heavy atoms | 12 |
| Hydrogen atoms | 9 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 4 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 4 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
