Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6874147107
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 | 20 USD | 98 | 20 working days | Get Quote |
| 5 mg | 20 USD | 98 | 20 working days | Get Quote |
| 10 mg | 34 USD | 98 | 20 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-2468175287
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-6874147107.sdf |
| SMILES | MCULE-6874147107.smiles |
| Standard InChI | MCULE-6874147107.inchi |
| InChIKey | MCULE-6874147107.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-892952871 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-889502730 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-867644088 | A2B Chem | Predominantly Building Block in stock | 98 | Main component as a main component | in stock |
| P-875810700 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-25955274 | AnalytiCon Discovery | Natural screening compounds (85%+) | 85 | Main component as a main component | 26 mg |
| P-873296199 | Angene | Building Blocks in stock | 98 | Main component as a main component | 700 mg |
| P-889552218 | AstaTech | In Stock BBs | 95 | Main component as a main component | in stock |
| P-889502885 | AstaTech | Backordered BBs | 95 | Main component as a main component | by synthesis |
| P-861357478 | Combi-Blocks | Building Block on demand | 95 | Main component as a main component | by synthesis |
| P-873245210 | Key Organics | Building Blocks | 97 | Main component as a main component | 10 mg |
| P-854694002 | MedChemExpress | Natural Products In stock | 95 | Main component as a main component | in stock |
| P-871075396 | MedKoo | In stock compounds | 95 | Main component as a main component | in stock |
| P-617404669 | Selleckchem | Product Catalog | N/A | Main component as a main component | in stock |
| P-892220070 | TargetMol | Screening Compounds - synthesis | 95 | Main component as a main component | by synthesis |
| P-892314521 | TargetMol | Screening Compounds - stock amount | 95 | Main component as a main component | unavailable |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 345.816 |
| logP | -1.324 |
| H-bond acceptors | 6 |
| H-bond donors | 1 |
| Rotatable bonds | 8 |
| PSA | 64.99 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 89.8944 |
| Atoms | 47 |
| Rings | 1 |
| Heavy atoms | 23 |
| Hydrogen atoms | 24 |
| Heteroatoms | 7 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 1 |
| Cis/trans stereo double bonds | 1 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
