Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3471879348
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 | 39 USD | 95 | 11 working days | Get Quote |
| 5 mg | 66 USD | 98 | 16 working days | Get Quote |
| 10 mg | 104 USD | 98 | 16 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-8849995922
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-3471879348.sdf |
| SMILES | MCULE-3471879348.smiles |
| Standard InChI | MCULE-3471879348.inchi |
| InChIKey | MCULE-3471879348.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-872829413 | A2B Chem | Predominantly Building Block in stock | 99 | As is | in stock |
| P-875782267 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869420250 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-868543585 | Axon Medchem | Axon predominantly SC catalog | 99 | As is | in stock |
| P-860799702 | Chiralstar | Chiralstar Building Blocks | 98 | As is | in stock |
| P-888640794 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
| P-869127875 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
| P-867620046 | A2B Chem | Predominantly Building Block in stock | 95 | Main component | in stock |
| P-875782266 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-865917044 | Angene | Building Blocks in stock | 98 | Main component | 75 mg |
| P-864148914 | AstaTech | In Stock BBs | 95 | Main component | in stock |
| P-851314778 | Chemshuttle | On request catalog | 95 | Main component | by synthesis |
| P-860799735 | Chiralstar | Chiralstar Building Blocks | 98 | Main component | in stock |
| P-579480638 | DC Chemicals Limited | Stock Products | 95 | Main component | in stock |
| P-868079216 | Hangzhou Apichem | Building Blocks in stock | 95 | Main component | in stock |
| P-855919736 | Key Organics | Building Blocks | 97 | Main component | 5 mg |
| P-854714551 | MedChemExpress | Screening compounds In stock | 95 | Main component | in stock |
| P-474025887 | MedKoo | In stock compounds | 95 | Main component | in stock |
| P-878640741 | Molnova | Stock | 98 | Main component | in stock |
| P-888640784 | TargetMol | Screening Compounds | 95 | Main component | by synthesis |
| P-869127863 | TargetMol | Screening Compounds - stock amount | 95 | Main component | in stock |
| P-611614933 | Toronto Research | In stock | 90 | Main component | in stock |
| P-854638433 | eNovation Chemicals LLC | Building Blocks in stock | 98 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 405.959 |
| logP | 4.7965 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 7 |
| PSA | 46.5 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 120.3062 |
| Atoms | 60 |
| Rings | 4 |
| Heavy atoms | 28 |
| Hydrogen atoms | 32 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| 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 |
