Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7942526379-0
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 | 69 USD | 95 | 8 working days | Get Quote |
| 5 mg | 69 USD | 95 | 8 working days | Get Quote |
| 10 mg | 69 USD | 95 | 8 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-5708543593-0
- Component type: Main
-
1
MCULE-6647815245-2
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-7942526379-0.sdf |
| SMILES | MCULE-7942526379-0.smiles |
| Standard InChI | MCULE-7942526379-0.inchi |
| InChIKey | MCULE-7942526379-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-4564134 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 25 mg |
| P-852145021 | A2B Chem | Predominantly Building Block on demand | 95 | Main component | by synthesis |
| P-875853263 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-893604074 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | Main component | 8 g |
| P-851587744 | AmBeed | On request | N/A | Main component | by synthesis |
| P-494375237 | Apollo Scientific | On request | 95 | Main component | by resynthesis (? - ? days) |
| P-481171788 | Atlantic Research Chemicals Ltd | In-stock Building Blocks | 95 | Main component | 7 g |
| P-590908549 | BLD pharm | Non-stock building blocks | 97 | Main component | by synthesis |
| P-861369882 | Combi-Blocks | Building Block on demand | 95 | Main component | by synthesis |
| P-889425318 | FluoroChem | General BB | 98 | Main component | in stock |
| P-454302220 | Key Organics | Screening Compounds and Fragments | 90 | Main component | unavailable |
| P-852483310 | Matrix Scientific | All | N/A | Main component | in stock |
| P-864076658 | MedChemExpress | Building Blocks on demand | 95 | Main component | by synthesis |
| P-886959318 | eNovation Chemicals LLC | Building Block on demand | 95 | Main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 374.226 |
| logP | 2.4073 |
| H-bond acceptors | 6 |
| H-bond donors | 2 |
| Rotatable bonds | 5 |
| PSA | 87.07 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 89.4446 |
| Atoms | 42 |
| Rings | 2 |
| Heavy atoms | 22 |
| Hydrogen atoms | 20 |
| 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 |
