Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1077858350
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 | 33 USD | 90 | 19 working days | Get Quote |
| 5 mg | 45 USD | 90 | 22 working days | Get Quote |
| 10 mg | 59 USD | 95 | 24 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-7480531309
- Component type: Main
-
1
MCULE-6647815245
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1077858350.sdf |
| SMILES | MCULE-1077858350.smiles |
| Standard InChI | MCULE-1077858350.inchi |
| InChIKey | MCULE-1077858350.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-892485190 | Asinex | General screening catalog | 90 | As is | unavailable |
| P-674219813 | ChemDiv | Discovery Chemistry Library | 90 | As is | 5 mg |
| P-34793165 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
| P-867542730 | A2B Chem | Predominantly Building Block in stock | 95 | Main component | in stock |
| P-875698778 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-869372940 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-851536173 | AmBeed | On request | N/A | Main component | by synthesis |
| P-611063559 | BLD pharm | Non-stock building blocks | 95 | Main component | by synthesis |
| P-868568269 | Combi-Blocks | Building Block in stock | 95 | Main component | in stock |
| P-580305147 | Debye Scientific | General Catalog | 95 | Main component | by resynthesis (? - ? days) |
| P-862042879 | FluoroChem | General BB | 95 | Main component | in stock |
| P-889373855 | FluoroChem | General BB | 95 | Main component | in stock |
| P-855946332 | Key Organics | Building Blocks | 95 | Main component | 1000 mg |
| P-854910711 | MedChemExpress | Building Blocks on demand | 95 | Main component | by synthesis |
| P-896209082 | Specs | Screening Compounds | 90 | Main component | 20 mg |
| P-888369339 | TimTec | ActiMol 4 Week - On demand | 94 | Main component | by resynthesis (? - ? days) |
| P-611476032 | Toronto Research | In stock | 90 | Main component | in stock |
| P-893679032 | eNovation Chemicals LLC | Building Block on demand | 95 | Main component | by synthesis |
| P-867670562 | A2B Chem | Predominantly Building Block in stock | 95 | Main component as a main component | in stock |
| P-886676575 | A2B Chem | Predominantly Building Block in stock | 95 | Main component as a main component | in stock |
| P-889978899 | AA Blocks | AA Blocks - synthesis | N/A | Main component as a main component | by synthesis |
| P-875844995 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-874642273 | AK Scientific | Building Blocks | 95 | Main component as a main component | in stock |
| P-851681832 | AmBeed | On request | N/A | Main component as a main component | by synthesis |
| P-851754312 | AmBeed | On request | N/A | Main component as a main component | by synthesis |
| P-611182733 | BLD pharm | Non-stock building blocks | 95 | Main component as a main component | by synthesis |
| P-611075638 | BLD pharm | Non-stock building blocks | 97 | Main component as a main component | by synthesis |
| P-492265429 | ChemBridge | Building Block Library | 95 | Main component as a main component | in stock |
| P-872447805 | ChemBridge | EXPRESS-Pick Collection | 90 | Main component as a main component | 100 mg |
| P-861389362 | Combi-Blocks | Building Block on demand | 95 | Main component as a main component | by synthesis |
| P-868569358 | Combi-Blocks | Building Block in stock | 95 | Main component as a main component | in stock |
| P-862082584 | FluoroChem | General BB | 95 | Main component as a main component | in stock |
| P-855951581 | Key Organics | Building Blocks | 95 | Main component as a main component | 1000 mg |
| P-854846984 | MedChemExpress | Building Blocks on demand | 95 | Main component as a main component | by synthesis |
| P-895727051 | MedChemExpress | Building Blocks on demand | 95 | Main component as a main component | by synthesis |
| P-611476033 | Toronto Research | In stock | 90 | Main component as a main component | in stock |
| P-611476034 | Toronto Research | In stock | 90 | Main component as a main component | in stock |
| P-617744121 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | Main component as a main component | 94 mg |
| P-893681706 | eNovation Chemicals LLC | Building Block on demand | 95 | Main component as a main component | by synthesis |
| P-893746925 | eNovation Chemicals LLC | Building Block on demand | 95 | Main component as a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 320.136 |
| logP | 1.7236 |
| H-bond acceptors | 6 |
| H-bond donors | 3 |
| Rotatable bonds | 4 |
| PSA | 95.86 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 68.4803 |
| Atoms | 32 |
| Rings | 1 |
| Heavy atoms | 18 |
| Hydrogen atoms | 14 |
| Heteroatoms | 7 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
