Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5539108467-1
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 | 12 USD | N/A | 22 working days | Get Quote |
| 5 mg | 12 USD | N/A | 22 working days | Get Quote |
| 10 mg | 12 USD | N/A | 22 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-4577971561-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5539108467-1.sdf |
| SMILES | MCULE-5539108467-1.smiles |
| Standard InChI | MCULE-5539108467-1.inchi |
| InChIKey | MCULE-5539108467-1.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-875846902 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-851410235 | AmBeed | On request | N/A | As is | by synthesis |
| P-889793319 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-590733467 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
| P-617651588 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-861532236 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-488548497 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-24386755 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
| P-596574625 | Key Organics | Building Blocks | 95 | As is | 1000 mg |
| P-870640653 | Key Organics | Screening Compounds and Fragments | 95 | As is | 100 mg |
| P-615635504 | LabNetwork | In stock | 95 | As is | in stock |
| P-854775031 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-454371357 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-675100979 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-611398357 | Toronto Research | In stock | 90 | As is | in stock |
| P-617771015 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.02 g |
| P-617724740 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1.02 g |
| P-893648930 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| P-867591328 | A2B Chem | Predominantly Building Block in stock | 98 | Main component | in stock |
| P-875749902 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-590389437 | AK Scientific | Building Blocks | 98 | Main component | in stock |
| P-893513609 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | Main component | 543.073 g |
| P-851940789 | AmBeed | In stock | N/A | Main component | in stock |
| P-865911291 | Angene | Building Blocks in stock | 98 | Main component | 29 g |
| P-494347494 | Apollo Scientific | In Stock | 95 | Main component | 550 mg |
| P-864163148 | AstaTech | In Stock BBs | 95 | Main component | in stock |
| P-619603386 | BLD pharm | In-stock building blocks | 98 | Main component | 36 g |
| P-868589876 | Combi-Blocks | Building Block in stock | 96 | Main component | in stock |
| P-580407162 | Debye Scientific | General Catalog | 95 | Main component | by resynthesis (? - ? days) |
| P-861926445 | FluoroChem | General BB | 97 | Main component | in stock |
| P-454394213 | Key Organics | Building Blocks | 95 | Main component | 154 mg |
| P-454304014 | Key Organics | Screening Compounds and Fragments | 95 | Main component | 154 mg |
| P-852379860 | Matrix Scientific | All | N/A | Main component | in stock |
| P-867944722 | MedChemExpress | Building Blocks in stock | 95 | Main component | in stock |
| P-500393282 | Pi Chemicals | Virtual Compounds | 97 | Main component | by synthesis |
| P-885518337 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component | by synthesis |
| P-498639681 | SV CHEMBIOTECH | SV Chembiotech Products | 95 | Main component | by synthesis |
| P-498639688 | SV CHEMBIOTECH | SV Chembiotech Products | 95 | Main component | by synthesis |
| P-873287122 | Shanghai iChemical | In stock | N/A | Main component | in stock |
| P-498667256 | Synthonix | In-stock Building Blocks | 98 | Main component | 35.2 g |
| P-502362591 | TimTec | Building Block Collection | 90 | Main component | in stock |
| P-893992562 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component | in stock |
| P-886815879 | A2B Chem | Predominantly Building Block in stock | 95 | Main component as a main component | in stock |
| P-890092873 | AA Blocks | AA Blocks - synthesis | N/A | Main component as a main component | by synthesis |
| P-861400629 | Combi-Blocks | Building Block on demand | 95 | Main component as a main component | by synthesis |
| P-893804790 | eNovation Chemicals LLC | Building Block on demand | 95 | Main component as a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 279.563 |
| logP | 1.8445 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 41.05 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 68.0557 |
| Atoms | 26 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 12 |
| Heteroatoms | 6 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
