Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9236376848
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 | 42 USD | 95 | 21 working days | Get Quote |
| 5 mg | 42 USD | 95 | 21 working days | Get Quote |
| 10 mg | 42 USD | 95 | 21 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-9236376848.sdf |
| SMILES | MCULE-9236376848.smiles |
| Standard InChI | MCULE-9236376848.inchi |
| InChIKey | MCULE-9236376848.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867552718 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875711189 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869251512 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-610898264 | Advanced ChemBlocks Inc (AChemBlock) | On demand | 90 | As is | by synthesis |
| P-864264831 | AstaTech | Backordered BBs | 97 | As is | by synthesis |
| P-492269183 | ChemBridge | Building Block Library | 95 | As is | in stock |
| P-868569314 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
| P-503876342 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
| P-492221969 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-855946436 | Key Organics | Building Blocks | 95 | As is | 1.017 g |
| P-870641137 | Key Organics | Screening Compounds and Fragments | 95 | As is | 1.017 g |
| P-888159704 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-854917779 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-492273361 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 1.15 g |
| P-12281717 | Otava | In-House Stock Library | 90 | As is | 1.15 g |
| P-33907528 | TimTec | ActiMol 6 Week | 90 | As is | in stock |
| P-502338201 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611610032 | Toronto Research | In stock | 90 | As is | in stock |
| P-893666436 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 227.685 |
| logP | 1.9836 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 6 |
| PSA | 38.33 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 60.1187 |
| Atoms | 29 |
| Rings | 1 |
| Heavy atoms | 15 |
| Hydrogen atoms | 14 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| 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 |
