Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7774617685
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 | 18 USD | 90 | 14 working days | Get Quote |
| 5 mg | 21 USD | 95 | 20 working days | Get Quote |
| 10 mg | 21 USD | 95 | 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.
| Name | File |
|---|---|
| SDF | MCULE-7774617685.sdf |
| SMILES | MCULE-7774617685.smiles |
| Standard InChI | MCULE-7774617685.inchi |
| InChIKey | MCULE-7774617685.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867644219 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875810348 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-892792460 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-893528247 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 109.045 g |
| P-606933129 | AmBeed | In stock | N/A | As is | in stock |
| P-619161868 | Angene | Building Blocks in stock | 95 | As is | 10 g |
| P-494322810 | Apollo Scientific | In Stock | 95 | As is | 2 g |
| P-864192433 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-481166104 | Atlantic Research Chemicals Ltd | In-stock Building Blocks | 95 | As is | 3 g |
| P-893261690 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-454726208 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-868599381 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
| P-580388640 | Debye Scientific | General Catalog | N/A | As is | by resynthesis (? - ? days) |
| P-861926641 | FluoroChem | General BB | 95 | As is | in stock |
| P-454400753 | Key Organics | Building Blocks | 95 | As is | 141.497 g |
| P-18807826 | Key Organics | Screening Compounds and Fragments | 95 | As is | 141.496 g |
| P-852414793 | Matrix Scientific | All | N/A | As is | in stock |
| P-855397564 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-579724594 | Menai Organics | Building blocks | 90 | As is | in stock |
| P-888164727 | Menai Organics | Screening compounds | 90 | As is | in stock |
| P-889871197 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-502359864 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-855223360 | Toronto Research | In stock | 90 | As is | in stock |
| P-615406862 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 254.207 |
| logP | 4.0561 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 48.14 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 60.1594 |
| Atoms | 27 |
| Rings | 2 |
| Heavy atoms | 18 |
| Hydrogen atoms | 9 |
| Heteroatoms | 6 |
| N/O atoms | 3 |
| 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 |
