Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2262843365
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 | 6 USD | N/A | 9 working days | Get Quote |
| 5 mg | 6 USD | N/A | 9 working days | Get Quote |
| 10 mg | 6 USD | N/A | 9 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-2969368671
- Component type: Main
-
1
MCULE-9925206507
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-2262843365.sdf |
| SMILES | MCULE-2262843365.smiles |
| Standard InChI | MCULE-2262843365.inchi |
| InChIKey | MCULE-2262843365.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-580411015 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-875694789 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-875752263 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-875753963 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-892792560 | AK Scientific | Building Blocks | 95 | Main component as a main component | in stock |
| P-892792557 | AK Scientific | Building Blocks | 95 | Main component as a main component | in stock |
| P-596956564 | Angene | Building Blocks in stock | 98 | Main component as a main component | 400 g |
| P-596937382 | Angene | Building Blocks in stock | 98 | Main component as a main component | 1000 g |
| P-596989418 | Angene | Building Blocks in stock | 98 | Main component as a main component | 2.3 kg |
| P-864203270 | AstaTech | In Stock BBs | 95 | Main component as a main component | in stock |
| P-580440010 | Debye Scientific | General Catalog | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-580299537 | Debye Scientific | General Catalog | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-580305654 | Debye Scientific | General Catalog | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-596574793 | Key Organics | Building Blocks | 97 | Main component as a main component | 25 g |
| P-596573194 | Key Organics | Building Blocks | 97 | Main component as a main component | 25 g |
| P-596572669 | Key Organics | Building Blocks | 97 | Main component as a main component | 25 g |
| P-855994837 | Key Organics | Screening Compounds and Fragments | 97 | Main component as a main component | 100 mg |
| P-870640545 | Key Organics | Screening Compounds and Fragments | 97 | Main component as a main component | 100 mg |
| P-864070233 | MedChemExpress | Building Blocks on demand | 95 | Main component as a main component | by synthesis |
| P-611450898 | Toronto Research | In stock | 90 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 185.292 |
| logP | 1.17688 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 31.47 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 60.7377 |
| Atoms | 27 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 15 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| 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 |
