Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5643857116
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 | 7 USD | 97 | 22 working days | Get Quote |
| 5 mg | 7 USD | 97 | 22 working days | Get Quote |
| 10 mg | 7 USD | 97 | 22 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-5643857116.sdf |
| SMILES | MCULE-5643857116.smiles |
| Standard InChI | MCULE-5643857116.inchi |
| InChIKey | MCULE-5643857116.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867625731 | A2B Chem | Predominantly Building Block in stock | 97 | As is | in stock |
| P-875789088 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-535625573 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505350434 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-869238166 | AK Scientific | Building Blocks | 99 | As is | in stock |
| P-903139279 | Aaron Chemicals LLC | Predominantly Building Block | 98 | As is | 1000 g |
| P-893510772 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 1.03616 kg |
| P-580238453 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
| P-606948086 | AmBeed | In stock | N/A | As is | in stock |
| P-596965386 | Angene | Building Blocks in stock | 98 | As is | 1000 g |
| P-494323914 | Apollo Scientific | In Stock | 95 | As is | 19 g |
| P-864102151 | AstaTech | In Stock BBs | 98 | As is | in stock |
| P-893255867 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-577089229 | Chemcia | Virtual compounds | 95 | As is | by synthesis |
| P-851247757 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-861283418 | Chiralstar | Chiralstar Building Blocks | 95 | As is | in stock |
| P-868554928 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-580420176 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-901366550 | FluoroChem | In Stock BB | N/A | As is | 50 g |
| P-870656318 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-505493443 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-454387178 | Key Organics | Building Blocks | 97 | As is | 100 g |
| P-855997927 | Key Organics | Screening Compounds and Fragments | 97 | As is | 100 mg |
| P-31251072 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-580515698 | Manchester Organics | Stock compounds | 99 | As is | 498 g |
| P-852377026 | Matrix Scientific | All | N/A | As is | in stock |
| P-854735775 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-588957579 | Otava | In-House Stock Library | 90 | As is | 500 mg |
| P-617692597 | Otava | Chemical Building Blocks for Prompt Delivery | 90 | As is | 500 mg |
| P-888861987 | PharmaBlock | In stock | N/A | As is | in stock |
| P-500383434 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-885548268 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-596773475 | Synthonix | In-stock Building Blocks | 95 | As is | 706.36 g |
| P-502370931 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-855007100 | Toronto Research | In stock | 90 | As is | in stock |
| P-893933093 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 157.099 |
| logP | 1.9627 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 66.05 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 37.245 |
| Atoms | 15 |
| Rings | 1 |
| Heavy atoms | 11 |
| Hydrogen atoms | 4 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| 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 |
