Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6623008209
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 | 65 USD | 97 | 10 working days | Get Quote |
| 5 mg | 71 USD | N/A | 9 working days | Get Quote |
| 10 mg | 71 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.
| Name | File |
|---|---|
| SDF | MCULE-6623008209.sdf |
| SMILES | MCULE-6623008209.smiles |
| Standard InChI | MCULE-6623008209.inchi |
| InChIKey | MCULE-6623008209.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867551810 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-867308116 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-888701134 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-615719101 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-893603591 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 70 mg |
| P-893445278 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 76.061 g |
| P-580212707 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
| P-580212714 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
| P-851954319 | AmBeed | In stock | N/A | As is | in stock |
| P-851487539 | AmBeed | On request | N/A | As is | by synthesis |
| P-895101382 | Angene | Building Blocks in stock | N/A | As is | 5 mg |
| P-865905630 | Angene | Building Blocks in stock | 95 | As is | 10 g |
| P-864206377 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-901410937 | FluoroChem | General BB | N/A | As is | in stock |
| P-887335563 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-454399948 | Key Organics | Building Blocks | 97 | As is | 12.306 g |
| P-18805801 | Key Organics | Screening Compounds and Fragments | 97 | As is | 12.306 g |
| P-892306343 | TargetMol | Natural Products | 95 | As is | in stock |
| P-869167827 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892301456 | TargetMol | In Stock BB | 95 | As is | unavailable |
| P-888661599 | TargetMol | Screening Compounds - stock amount | 95 | As is | 185 mg |
| P-502393057 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611571967 | Toronto Research | In stock | 90 | As is | in stock |
| P-868509780 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 164.200 |
| logP | 1.7007 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 29.46 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 48.9938 |
| Atoms | 24 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 12 |
| Heteroatoms | 2 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
