Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8191975979
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 | 140 USD | 98 | 22 working days | Get Quote |
| 5 mg | 140 USD | 98 | 22 working days | Get Quote |
| 10 mg | 279 USD | 98 | 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.
-
MCULE-3161214118
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-8191975979.sdf |
| SMILES | MCULE-8191975979.smiles |
| Standard InChI | MCULE-8191975979.inchi |
| InChIKey | MCULE-8191975979.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-612902945 | A2B Chem | Predominantly Building Block on demand | 98 | As is | by synthesis |
| P-890149474 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-595222179 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-867722250 | AmBeed | On request | N/A | As is | by synthesis |
| P-489233008 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-872722990 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-590761651 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
| P-901544497 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-860798257 | Chiralstar | Chiralstar Building Blocks | 98 | As is | in stock |
| P-608495557 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
| P-852463615 | Matrix Scientific | All | N/A | As is | in stock |
| P-895180789 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-888169100 | Molnova | On demand | 98 | As is | by synthesis |
| P-867612720 | A2B Chem | Predominantly Building Block in stock | 99 | As a main component | in stock |
| P-875773014 | AA Blocks | AA Blocks - in stock | N/A | As a main component | in stock |
| P-894655912 | AK Scientific | Building Blocks | 95 | As a main component | in stock |
| P-903114169 | Aaron Chemicals LLC | Predominantly Building Block | N/A | As a main component | 50 mg |
| P-904320193 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As a main component | 52 mg |
| P-851431143 | AmBeed | On request | N/A | As a main component | by synthesis |
| P-895096485 | Angene | Building Blocks in stock | N/A | As a main component | 50 mg |
| P-889498149 | AstaTech | Backordered BBs | 95 | As a main component | by synthesis |
| P-590749884 | BLD pharm | Non-stock building blocks | 98 | As a main component | by synthesis |
| P-901544496 | Biosynth | Synthesis | 95 | As a main component | by synthesis |
| P-887185875 | Combi-Blocks | Building Block on demand | 95 | As a main component | by synthesis |
| P-608495554 | DC Chemicals Limited | Stock Products | 95 | As a main component | in stock |
| P-873248561 | Key Organics | Building Blocks | 95 | As a main component | 5 mg |
| P-854713251 | MedChemExpress | Screening compounds In stock | 95 | As a main component | in stock |
| P-871075125 | MedKoo | In stock compounds | 95 | As a main component | in stock |
| P-888169099 | Molnova | On demand | 98 | As a main component | by synthesis |
| P-893673711 | eNovation Chemicals LLC | Building Block on demand | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 426.541 |
| logP | 3.2937 |
| H-bond acceptors | 9 |
| H-bond donors | 3 |
| Rotatable bonds | 8 |
| PSA | 135.5 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 118.6542 |
| Atoms | 56 |
| Rings | 4 |
| Heavy atoms | 30 |
| Hydrogen atoms | 26 |
| Heteroatoms | 10 |
| N/O atoms | 9 |
| 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 |
