Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7790805968
Compound
Show structures
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 | 156 USD | 90 | 12 working days | Get Quote |
| 5 mg | 156 USD | 90 | 12 working days | Get Quote |
| 10 mg | 156 USD | 90 | 12 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.
| Name | File |
|---|---|
| SDF | MCULE-7790805968.sdf |
| SMILES | MCULE-7790805968.smiles |
| Standard InChI | MCULE-7790805968.inchi |
| InChIKey | MCULE-7790805968.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-852141746 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
| P-889962268 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
| P-894656023 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-436463725 | Alinda | Building Blocks | 95 | As is | in stock |
| P-851739700 | AmBeed | On request | N/A | As is | by synthesis |
| P-591058857 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
| P-577174782 | ChemDiv | Building Blocks on demand | 90 | As is | by synthesis |
| P-861539408 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-492228317 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-675482757 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-502492468 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-502567933 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-855974896 | Key Organics | Building Blocks | 95 | As is | 1000 mg |
| P-852434221 | Matrix Scientific | All | N/A | As is | in stock |
| P-854954006 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-491181442 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-23210079 | TimTec | ActiMol 6 Week | 90 | As is | in stock |
| P-502388124 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-855360490 | Toronto Research | In stock | 90 | As is | in stock |
| P-588726375 | VITAS M CHEMICAL LIMITED | Virtual synthesis library | N/A | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 201.224 |
| logP | 1.9087 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 71.77 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 59.6641 |
| Atoms | 26 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 11 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 |
