Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3161364448
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 | 13 USD | 97 | 20 working days | Get Quote |
| 5 mg | 13 USD | 97 | 20 working days | Get Quote |
| 10 mg | 13 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.
-
1
MCULE-7413972507
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-3161364448.sdf |
| SMILES | MCULE-3161364448.smiles |
| Standard InChI | MCULE-3161364448.inchi |
| InChIKey | MCULE-3161364448.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-24383047 | InterBioScreen | Screening Compounds | 92 | As is | 281 mg |
| P-13734822 | Pharmeks LLC | Synthetic compounds | 92 | As is | 282 mg |
| P-617773704 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 59 mg |
| P-867606721 | A2B Chem | Predominantly Building Block in stock | 97 | Main component | in stock |
| P-875765227 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-597023653 | AEchem | Building blocks | 95 | Main component | in stock |
| P-590401320 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-903103004 | Aaron Chemicals LLC | Predominantly Building Block | 97 | Main component | 25 g |
| P-610975479 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | Main component | 748.63 g |
| P-580265638 | Aldlab Chemicals | Building Block Custom Synth | 95 | Main component | by synthesis |
| P-875897189 | Allbio Pharm | In stock | N/A | Main component | in stock |
| P-606865269 | AmBeed | In stock | N/A | Main component | in stock |
| P-489174900 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | Main component | in stock |
| P-596961159 | Angene | Building Blocks in stock | 97 | Main component | 25 g |
| P-605399975 | Apollo Scientific | In Stock | 95 | Main component | 1.75 g |
| P-889518188 | AstaTech | Backordered BBs | 95 | Main component | by synthesis |
| P-864085166 | AstaTech | In Stock BBs | 97 | Main component | in stock |
| P-580715891 | BLD pharm | In-stock building blocks | 97 | Main component | 7.35 g |
| P-577180595 | ChemDiv | Building Blocks on demand | 90 | Main component | by synthesis |
| P-577098406 | Chemcia | Stock compounds | 95 | Main component | in stock |
| P-577098407 | Chemcia | Stock compounds | 95 | Main component | in stock |
| P-851245337 | Chemshuttle | On request catalog | 95 | Main component | by synthesis |
| P-861274240 | Chiralstar | Chiralstar Building Blocks | 95 | Main component | in stock |
| P-868563655 | Combi-Blocks | Building Block in stock | 97 | Main component | in stock |
| P-868580796 | Combi-Blocks | Building Block in stock | 97 | Main component | in stock |
| P-580306964 | Debye Scientific | General Catalog | 95 | Main component | by resynthesis (? - ? days) |
| P-901369479 | FluoroChem | In Stock BB | N/A | Main component | 250 mg |
| P-505493391 | Hangzhou Apichem | Building Blocks in stock | 95 | Main component | in stock |
| P-500155091 | J&W Pharmlab | In-stock compounds | 96 | Main component | in stock |
| P-454412543 | Key Organics | Building Blocks | 95 | Main component | 500 mg |
| P-454343820 | Key Organics | Screening Compounds and Fragments | 95 | Main component | 100 mg |
| P-579611267 | LabSeeker, Inc | Stock Collection | 95 | Main component | in stock |
| P-852496208 | Matrix Scientific | All | N/A | Main component | in stock |
| P-854734414 | MedChemExpress | Building Blocks in stock | 95 | Main component | in stock |
| P-888868492 | PharmaBlock | In stock | N/A | Main component | in stock |
| P-885545290 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component | by synthesis |
| P-579703489 | Sinova Inc. | In-stock Building Blocks | N/A | Main component | in stock |
| P-502372632 | TimTec | Building Block Collection | 90 | Main component | in stock |
| P-611385763 | Toronto Research | In stock | 90 | Main component | in stock |
| P-893646471 | eNovation Chemicals LLC | Building Block on demand | 95 | Main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 233.048 |
| logP | 2.7165 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 65.98 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 55.028 |
| Atoms | 20 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 6 |
| Heteroatoms | 6 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
