Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9146979557
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 | 76 USD | 90 | 22 working days | Get Quote |
| 5 mg | 98 USD | 90 | 22 working days | Get Quote |
| 10 mg | 123 USD | 90 | 22 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-9146979557.sdf |
| SMILES | MCULE-9146979557.smiles |
| Standard InChI | MCULE-9146979557.inchi |
| InChIKey | MCULE-9146979557.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867318395 | A2B Chem | Predominantly Building Block on demand | 90 | As is | by synthesis |
| P-889963008 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
| P-893456132 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 686 mg |
| P-851847911 | AmBeed | On request | N/A | As is | by synthesis |
| P-596492679 | Asinex | General bb catalog | 90 | As is | 1000 mg |
| P-596411098 | Asinex | General screening catalog | 90 | As is | 1000 mg |
| P-591019293 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
| P-6213793 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 25 mg |
| P-577178481 | ChemDiv | Building Blocks on demand | 90 | As is | by synthesis |
| P-861367622 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-861948197 | FluoroChem | General BB | N/A | As is | in stock |
| P-502444324 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-502607762 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-492215556 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-14055210 | Life Chemicals | Building Blocks | 90 | As is | 681 mg |
| P-601061742 | Life Chemicals | Screening Compounds | 90 | As is | 681 mg |
| P-852401851 | Matrix Scientific | All | N/A | As is | in stock |
| P-895263749 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-23300890 | TimTec | ActiMol 6 Week | 90 | As is | in stock |
| P-502340591 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-855253806 | Toronto Research | In stock | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 299.345 |
| logP | 2.3417 |
| H-bond acceptors | 6 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 92.29 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 76.5318 |
| Atoms | 37 |
| Rings | 2 |
| Heavy atoms | 20 |
| Hydrogen atoms | 17 |
| Heteroatoms | 7 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
