Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1921499437-0
Structure
Show compound
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 | 9 USD | N/A | 14 working days | Get Quote |
| 5 mg | 9 USD | N/A | 14 working days | Get Quote |
| 10 mg | 9 USD | N/A | 14 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-2415764032-2
- Component type: Main
-
1
MCULE-3743781291-0
- Component type: Counter Ion
-
3
MCULE-3833394421-0
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1921499437-0.sdf |
| SMILES | MCULE-1921499437-0.smiles |
| Standard InChI | MCULE-1921499437-0.inchi |
| InChIKey | MCULE-1921499437-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-489157890 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-535626428 | AK Scientific | Building Blocks | 95 | Main component as a main component | in stock |
| P-505352939 | AK Scientific | Building Blocks | 98 | Main component as a main component | in stock |
| P-606869103 | AmBeed | In stock | N/A | Main component as a main component | in stock |
| P-489123260 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | Main component as a main component | in stock |
| P-864183751 | AstaTech | In Stock BBs | 95 | Main component as a main component | in stock |
| P-868591713 | Combi-Blocks | Building Block in stock | 98 | Main component as a main component | in stock |
| P-862031656 | FluoroChem | General BB | N/A | Main component as a main component | in stock |
| P-870658740 | Glentham Life Sciences | Compounds typically in stock | 99 | Main component as a main component | in stock |
| P-524163340 | Key Organics | Building Blocks | 98 | Main component as a main component | 1000 g |
| P-852467289 | Matrix Scientific | All | N/A | Main component as a main component | in stock |
| P-621857824 | Otava | Tangible screening compounds | 90 | Main component as a main component | by synthesis |
| P-885560625 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component as a main component | by synthesis |
| P-611498173 | Toronto Research | In stock | 90 | Main component as a main component | in stock |
| P-575325304 | eNovation Chemicals LLC | Building Blocks in stock | 97 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 5 |
| Mass | 203.037 |
| logP | -4.0517 |
| H-bond acceptors | 6 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 129.34 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 21.0339 |
| Atoms | 16 |
| Rings | 0 |
| Heavy atoms | 12 |
| Hydrogen atoms | 4 |
| Heteroatoms | 9 |
| N/O atoms | 6 |
| Inorganic atoms | 3 |
| Halogen atoms | 0 |
| 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 |
