Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6125508545-1
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 | 33 USD | 90 | 23 working days | Get Quote |
| 5 mg | 51 USD | 90 | 19 working days | Get Quote |
| 10 mg | 65 USD | 90 | 19 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-8855804390-0
- Component type: Main
-
1
MCULE-6647815245-2
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-6125508545-1.sdf |
| SMILES | MCULE-6125508545-1.smiles |
| Standard InChI | MCULE-6125508545-1.inchi |
| InChIKey | MCULE-6125508545-1.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-580089729 | Eximed | Building Block Catalog | 95 | As is | 8.11 g |
| P-579804827 | Eximed | In-stock screening compounds | 90 | As is | 8.11 g |
| P-870580339 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-870569111 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-488546416 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-24290363 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
| P-617666223 | Otava | In-House Stock Library | 90 | As is | 11.11 g |
| P-620221410 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 11.11 g |
| P-454370794 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-852103385 | A2B Chem | Predominantly Building Block on demand | 95 | Main component | by synthesis |
| P-889931249 | AA Blocks | AA Blocks - synthesis | N/A | Main component | by synthesis |
| P-612942750 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-851529525 | AmBeed | On request | N/A | Main component | by synthesis |
| P-596422701 | Asinex | General screening catalog | 90 | Main component | 1000 mg |
| P-596493627 | Asinex | General bb catalog | 90 | Main component | 1000 mg |
| P-590790901 | BLD pharm | Non-stock building blocks | 98 | Main component | by synthesis |
| P-861285026 | Chiralstar | Chiralstar Building Blocks | 95 | Main component | in stock |
| P-861341148 | Combi-Blocks | Building Block on demand | 95 | Main component | by synthesis |
| P-596594900 | Key Organics | Building Blocks | 90 | Main component | 1000 mg |
| P-852382858 | Matrix Scientific | All | N/A | Main component | in stock |
| P-854886788 | MedChemExpress | Building Blocks on demand | 95 | Main component | by synthesis |
| P-19365565 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
| P-502340256 | TimTec | Building Block Collection | 90 | Main component | in stock |
| P-2524035 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | Main component | 115 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 266.293 |
| logP | 1.6603 |
| H-bond acceptors | 6 |
| H-bond donors | 3 |
| Rotatable bonds | 4 |
| PSA | 99.52 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 69.1973 |
| Atoms | 37 |
| Rings | 2 |
| Heavy atoms | 19 |
| Hydrogen atoms | 18 |
| Heteroatoms | 6 |
| N/O atoms | 6 |
| 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 | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
