Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5680962870-0
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 | 51 USD | 90 | 19 working days | Get Quote |
| 5 mg | 74 USD | 90 | 19 working days | Get Quote |
| 10 mg | 93 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-7196755746-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5680962870-0.sdf |
| SMILES | MCULE-5680962870-0.smiles |
| Standard InChI | MCULE-5680962870-0.inchi |
| InChIKey | MCULE-5680962870-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-31243650 | LaboTest | Screening Collection | 90 | As is | 200 mg |
| P-852552042 | Matrix Scientific | All | N/A | As is | in stock |
| P-895833541 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-592667091 | Otava | Virtual BB | 95 | As is | by synthesis |
| P-675089637 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-873002252 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 90 mg |
| P-617758518 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 116 mg |
| P-867459253 | A2B Chem | Predominantly Building Block on demand | N/A | Main component | by synthesis |
| P-894671979 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-596499464 | Asinex | General bb catalog | 90 | Main component | unavailable |
| P-854889496 | MedChemExpress | Building Blocks on demand | 95 | Main component | by synthesis |
| P-886715679 | A2B Chem | Predominantly Building Block in stock | 95 | Main component as a main component | in stock |
| P-890014884 | AA Blocks | AA Blocks - synthesis | N/A | Main component as a main component | by synthesis |
| P-869310785 | AK Scientific | Building Blocks | 95 | Main component as a main component | in stock |
| P-903286252 | Aaron Chemicals LLC | Predominantly Building Block | 95 | Main component as a main component | 5 g |
| P-851611447 | AmBeed | On request | N/A | Main component as a main component | by synthesis |
| P-851644887 | AmBeed | On request | N/A | Main component as a main component | by synthesis |
| P-851879106 | AmBeed | On request | N/A | Main component as a main component | by synthesis |
| P-892490759 | Asinex | General screening catalog | 90 | Main component as a main component | 1000 mg |
| P-889819589 | AstaTech | Backordered BBs | 95 | Main component as a main component | by synthesis |
| P-611083677 | BLD pharm | Non-stock building blocks | 95 | Main component as a main component | by synthesis |
| P-611139560 | BLD pharm | Non-stock building blocks | 95 | Main component as a main component | by synthesis |
| P-591147108 | BLD pharm | Non-stock building blocks | 97 | Main component as a main component | by synthesis |
| P-852385392 | Matrix Scientific | All | N/A | Main component as a main component | in stock |
| P-854862197 | MedChemExpress | Building Blocks on demand | 95 | Main component as a main component | by synthesis |
| P-895464524 | MedChemExpress | Building Blocks on demand | 95 | Main component as a main component | by synthesis |
| P-873214483 | TimTec | Building Block Collection | 90 | Main component as a main component | in stock |
| P-903651670 | TimTec | ActiMol 4 Week - On demand | 94 | Main component as a main component | by resynthesis (? - ? days) |
| P-893810328 | eNovation Chemicals LLC | Building Block on demand | 95 | Main component as a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 175.658 |
| logP | 2.5485 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 54.7 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 47.9651 |
| Atoms | 25 |
| Rings | 1 |
| Heavy atoms | 11 |
| Hydrogen atoms | 14 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
