Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4788692981
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 | 12 USD | N/A | 14 working days | Get Quote |
| 5 mg | 20 USD | N/A | 14 working days | Get Quote |
| 10 mg | 25 USD | N/A | 14 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-5639095348
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-4788692981.sdf |
| SMILES | MCULE-4788692981.smiles |
| Standard InChI | MCULE-4788692981.inchi |
| InChIKey | MCULE-4788692981.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867570343 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875730523 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-590359869 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-505402004 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-610959787 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 13.984 g |
| P-606883349 | AmBeed | In stock | N/A | As is | in stock |
| P-489139060 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596949256 | Angene | Building Blocks in stock | 98 | As is | 6.301 g |
| P-580192749 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-864125476 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-868544707 | Axon Medchem | Axon predominantly SC catalog | 98 | As is | in stock |
| P-580720285 | BLD pharm | In-stock building blocks | 98 | As is | 1.2 g |
| P-851251949 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-860798333 | Chiralstar | Chiralstar Building Blocks | 98 | As is | in stock |
| P-868621727 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-579478666 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
| P-675216228 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-524167240 | Key Organics | Building Blocks | 95 | As is | 10 mg |
| P-579628637 | LabSeeker, Inc | Stock Collection | 98 | As is | in stock |
| P-852524228 | Matrix Scientific | All | N/A | As is | in stock |
| P-854715706 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-474026844 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-608270420 | Molnova | Stock | 98 | As is | in stock |
| P-579712248 | Selleckchem | Product Catalog | N/A | As is | in stock |
| P-851368437 | Synthonix | In-stock Building Blocks | 97 | As is | 33.61 g |
| P-888644114 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
| P-464641270 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
| P-611359970 | Toronto Research | In stock | 90 | As is | in stock |
| P-611359981 | Toronto Research | In stock | 90 | As is | in stock |
| P-886927806 | eNovation Chemicals LLC | Building Block on demand | 97 | As is | by synthesis |
| P-867410490 | A2B Chem | Predominantly Building Block on demand | 98 | As a main component | by synthesis |
| P-608495885 | DC Chemicals Limited | Stock Products | 95 | As a main component | in stock |
| P-888169554 | Molnova | On demand | 98 | As a main component | by synthesis |
| P-885532896 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As a main component | by synthesis |
| P-888633072 | TargetMol | Screening Compounds | 95 | As a main component | by synthesis |
| P-869117935 | TargetMol | Screening Compounds - stock amount | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 423.440 |
| logP | 4.4716 |
| H-bond acceptors | 8 |
| H-bond donors | 3 |
| Rotatable bonds | 11 |
| PSA | 97.4 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 116.9141 |
| Atoms | 53 |
| Rings | 3 |
| Heavy atoms | 31 |
| Hydrogen atoms | 22 |
| Heteroatoms | 9 |
| N/O atoms | 8 |
| 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 |
