Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6438261938-1
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 | 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-9642506548-1
- Component type: Main
-
1
MCULE-5646000632-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-6438261938-1.sdf |
| SMILES | MCULE-6438261938-1.smiles |
| Standard InChI | MCULE-6438261938-1.inchi |
| InChIKey | MCULE-6438261938-1.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-875748965 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-616208311 | AK Scientific | Building Blocks | 98 | Main component as a main component | in stock |
| P-851926411 | AmBeed | In stock | N/A | Main component as a main component | in stock |
| P-619151535 | Angene | Building Blocks in stock | 98 | Main component as a main component | 5.5 kg |
| P-616202810 | BLD pharm | In-stock building blocks | 97 | Main component as a main component | 1.525 kg |
| P-868599811 | Combi-Blocks | Building Block in stock | 98 | Main component as a main component | in stock |
| P-896536203 | FluoroChem | In Stock BB | 95 | Main component as a main component | 100 g |
| P-855910220 | Key Organics | Building Blocks | 98 | Main component as a main component | 1000 g |
| P-856078612 | LabSeeker, Inc | Stock Collection | 95 | Main component as a main component | in stock |
| P-620066486 | Otava | In-House Stock Library | 90 | Main component as a main component | 1.52 g |
| P-885547492 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component as a main component | by synthesis |
| P-888449297 | TimTec | ActiMol 4 Week - On demand | 94 | Main component as a main component | by resynthesis (? - ? days) |
| P-666975246 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 191.207 |
| logP | 1.7533 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 85.81 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 42.4572 |
| Atoms | 21 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 9 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| 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 |
