Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4672660788
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-4672660788.sdf |
| SMILES | MCULE-4672660788.smiles |
| Standard InChI | MCULE-4672660788.inchi |
| InChIKey | MCULE-4672660788.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867662353 | A2B Chem | Predominantly Building Block in stock | 97 | As is | in stock |
| P-875831372 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-590356884 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-893533049 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 41.8 g |
| P-675239218 | Allbio Pharm | In stock | N/A | As is | in stock |
| P-606877603 | AmBeed | In stock | N/A | As is | in stock |
| P-489121976 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596973090 | Angene | Building Blocks in stock | 97 | As is | 10 g |
| P-494312972 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864162490 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-580705457 | BLD pharm | In-stock building blocks | 97 | As is | 1000 mg |
| P-893228897 | Biosynth | In Stock | 95 | As is | in stock |
| P-868644342 | Combi-Blocks | Building Block in stock | 96 | As is | in stock |
| P-580419549 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-580409059 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-861978122 | FluoroChem | General BB | N/A | As is | in stock |
| P-505549769 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-454405503 | Key Organics | Building Blocks | 95 | As is | 4.659 g |
| P-18814296 | Key Organics | Screening Compounds and Fragments | 95 | As is | 4.659 g |
| P-608121616 | LabSeeker, Inc | Stock Collection | 95 | As is | in stock |
| P-580515084 | Manchester Organics | Stock compounds | 97 | As is | 3 g |
| P-852417316 | Matrix Scientific | All | N/A | As is | in stock |
| P-854725305 | MedChemExpress | In stock Building Blocks | 95 | As is | in stock |
| P-888885070 | PharmaBlock | In stock | N/A | As is | in stock |
| P-868803001 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-596763258 | Synthonix | In-stock Building Blocks | 97 | As is | 53.4 g |
| P-502401275 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611366475 | Toronto Research | In stock | 90 | As is | in stock |
| P-893947205 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 215.985 |
| logP | 3.4072 |
| H-bond acceptors | 1 |
| H-bond donors | 0 |
| Rotatable bonds | 1 |
| PSA | 12.89 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 39.259 |
| Atoms | 14 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 2 |
| Heteroatoms | 6 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 5 |
| 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 |
