Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7700459933
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 | 35 USD | 90 | 19 working days | Get Quote |
| 5 mg | 52 USD | 90 | 19 working days | Get Quote |
| 10 mg | 67 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-8716493699
- Component type: Main
-
1
MCULE-6647815245
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-7700459933.sdf |
| SMILES | MCULE-7700459933.smiles |
| Standard InChI | MCULE-7700459933.inchi |
| InChIKey | MCULE-7700459933.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-34560668 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
| P-860642899 | A2B Chem | Predominantly Building Block on demand | N/A | Main component | by synthesis |
| P-851444191 | AmBeed | On request | N/A | Main component | by synthesis |
| P-596515548 | Asinex | General bb catalog | 90 | Main component | unavailable |
| P-590747387 | BLD pharm | Non-stock building blocks | 95 | Main component | by synthesis |
| P-889354035 | FluoroChem | General BB | 95 | Main component | in stock |
| P-596591997 | Key Organics | Building Blocks | 90 | Main component | 1000 mg |
| P-588250689 | Manchester Organics | Compounds on demand | N/A | Main component | by synthesis |
| P-854890864 | MedChemExpress | Building Blocks on demand | 95 | Main component | by synthesis |
| P-868811688 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component | by synthesis |
| P-23891158 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
| P-502331488 | TimTec | Building Block Collection | 90 | Main component | in stock |
| P-855213565 | Toronto Research | In stock | 90 | Main component | in stock |
| P-1037769 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | Main component | 2.068 g |
| P-464674139 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | Main component | 2.068 g |
| P-867670550 | A2B Chem | Predominantly Building Block in stock | 95 | Main component as a main component | in stock |
| P-875844493 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-894647280 | AK Scientific | Building Blocks | 95 | Main component as a main component | in stock |
| P-851779746 | AmBeed | On request | N/A | Main component as a main component | by synthesis |
| P-892488463 | Asinex | General screening catalog | 90 | Main component as a main component | 1000 mg |
| P-611145321 | BLD pharm | Non-stock building blocks | 95 | Main component as a main component | by synthesis |
| P-870581344 | Combi-Blocks | Building Block in stock | 95 | Main component as a main component | in stock |
| P-861943905 | FluoroChem | General BB | N/A | Main component as a main component | in stock |
| P-855951956 | Key Organics | Building Blocks | 95 | Main component as a main component | 1000 mg |
| P-852382974 | Matrix Scientific | All | N/A | Main component as a main component | in stock |
| P-854936410 | MedChemExpress | Building Blocks on demand | 95 | Main component as a main component | by synthesis |
| P-611421289 | Toronto Research | In stock | 90 | Main component as a main component | in stock |
| P-893664009 | eNovation Chemicals LLC | Building Block on demand | 95 | Main component as a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 287.284 |
| logP | 1.4967 |
| H-bond acceptors | 6 |
| H-bond donors | 3 |
| Rotatable bonds | 6 |
| PSA | 95.86 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 69.7523 |
| Atoms | 38 |
| Rings | 1 |
| Heavy atoms | 20 |
| Hydrogen atoms | 18 |
| Heteroatoms | 7 |
| N/O atoms | 6 |
| 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 |
