Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4251826917
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 | 33 USD | 90 | 19 working days | Get Quote |
| 5 mg | 49 USD | 90 | 19 working days | Get Quote |
| 10 mg | 51 USD | 95 | 22 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-5362569891
- Component type: Main
-
1
MCULE-4684386765
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-4251826917.sdf |
| SMILES | MCULE-4251826917.smiles |
| Standard InChI | MCULE-4251826917.inchi |
| InChIKey | MCULE-4251826917.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-886051624 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-617181678 | Life Chemicals | Screening Compounds | 90 | As is | 80 mg |
| P-867534415 | A2B Chem | Predominantly Building Block in stock | 95 | Main component | in stock |
| P-875688548 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-615710532 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-851937764 | AmBeed | In stock | N/A | Main component | in stock |
| P-865901979 | Angene | Building Blocks in stock | 95 | Main component | 1.5 g |
| P-865981159 | AsisChem | In-stock Compounds for biological screening | 95 | Main component | in stock |
| P-864208292 | AstaTech | In Stock BBs | 95 | Main component | in stock |
| P-591023854 | BLD pharm | Non-stock building blocks | 95 | Main component | by synthesis |
| P-889733494 | Combi-Blocks | Building Block on demand | 95 | Main component | by synthesis |
| P-889350663 | FluoroChem | General BB | 95 | Main component | in stock |
| P-588255609 | Manchester Organics | Compounds on demand | N/A | Main component | by synthesis |
| P-852466898 | Matrix Scientific | All | N/A | Main component | in stock |
| P-854885615 | MedChemExpress | Building Blocks on demand | 95 | Main component | by synthesis |
| P-19472938 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
| P-885522294 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component | by synthesis |
| P-611381921 | Toronto Research | In stock | 90 | Main component | in stock |
| P-3215191 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | Main component | 12.654 g |
| P-1090777 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | Main component | 12.654 g |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 337.444 |
| logP | 3.5473 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 101.96 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 102.6787 |
| Atoms | 41 |
| Rings | 3 |
| Heavy atoms | 21 |
| Hydrogen atoms | 20 |
| Heteroatoms | 5 |
| N/O atoms | 2 |
| 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 |
