Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6463665210-0
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 | 11 USD | 98 | 20 working days | Get Quote |
| 5 mg | 28 USD | 98 | 16 working days | Get Quote |
| 10 mg | 28 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-3809430132-1
- Component type: Main
-
3
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-6463665210-0.sdf |
| SMILES | MCULE-6463665210-0.smiles |
| Standard InChI | MCULE-6463665210-0.inchi |
| InChIKey | MCULE-6463665210-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-606837912 | AmBeed | In stock | N/A | As is | in stock |
| P-596971794 | Angene | Building Blocks in stock | 98 | As is | 10 g |
| P-872722759 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-893256977 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-900266273 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
| P-901410892 | FluoroChem | General BB | N/A | As is | in stock |
| P-596584149 | Key Organics | Building Blocks | 97 | As is | 100 mg |
| P-474021629 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-608279409 | Molnova | Stock | 98 | As is | in stock |
| P-894613653 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-865931606 | Angene | Building Blocks in stock | 98 | Main component | 1.25 g |
| P-894006549 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component | in stock |
| P-31189318 | LaboTest | Screening Collection | 90 | Main component as a main component | unavailable |
| Property | Value |
|---|---|
| Components | 4 |
| Mass | 533.875 |
| logP | 6.6395 |
| H-bond acceptors | 7 |
| H-bond donors | 3 |
| Rotatable bonds | 3 |
| PSA | 84.07 |
| RO5 violations | 2 |
| RO3 violations | 4 |
| Refractivity | 155.7954 |
| Atoms | 62 |
| Rings | 6 |
| Heavy atoms | 35 |
| Hydrogen atoms | 27 |
| Heteroatoms | 10 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| 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 |
