Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2253455268
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 | 18 USD | 98 | 20 working days | Get Quote |
| 5 mg | 18 USD | 98 | 20 working days | Get Quote |
| 10 mg | 18 USD | 98 | 20 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-7723795613
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-2253455268.sdf |
| SMILES | MCULE-2253455268.smiles |
| Standard InChI | MCULE-2253455268.inchi |
| InChIKey | MCULE-2253455268.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867310244 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-874631941 | AK Scientific | Building Blocks | 97 | As is | in stock |
| P-895102169 | Angene | Building Blocks in stock | 98 | As is | 4 g |
| P-896032020 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-861398135 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-895183117 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-875833763 | AA Blocks | AA Blocks - in stock | N/A | As a main component | in stock |
| P-869191053 | AK Scientific | Building Blocks | 95 | As a main component | in stock |
| P-505403819 | AK Scientific | Building Blocks | 99 | As a main component | in stock |
| P-505391952 | AK Scientific | Building Blocks | 98 | As a main component | in stock |
| P-893591047 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As a main component | 20.2 g |
| P-489170912 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As a main component | in stock |
| P-873297679 | Angene | Building Blocks in stock | 98 | As a main component | 10 g |
| P-494342538 | Apollo Scientific | On request | 95 | As a main component | by resynthesis (? - ? days) |
| P-889570481 | AstaTech | In Stock BBs | 95 | As a main component | in stock |
| P-893229324 | Biosynth | In Stock | 95 | As a main component | in stock |
| P-505576691 | Bosche Scientific | Bosche Products | 98 | As a main component | in stock |
| P-580008987 | Innovapharm | Screening Compounds | 90 | As a main component | in stock |
| P-675519873 | Innovapharm | Virtual Screening Compounds | 90 | As a main component | by synthesis |
| P-524164494 | Key Organics | Building Blocks | 98 | As a main component | 5 mg |
| P-856042599 | LaboTest | Building Blocks | 90 | As a main component | 10 g |
| P-31164872 | LaboTest | Screening Collection | 90 | As a main component | 10 g |
| P-584618603 | MedKoo | In stock compounds | 95 | As a main component | in stock |
| P-608277992 | Molnova | Stock | 98 | As a main component | in stock |
| P-500392417 | Pi Chemicals | Virtual Compounds | 98 | As a main component | by synthesis |
| P-856073472 | Princeton Biomolecular Research | Building Block Stock | 95 | As a main component | 1000 mg |
| P-502365490 | TimTec | Building Block Collection | 90 | As a main component | in stock |
| P-854960651 | Toronto Research | In stock | 90 | As a main component | in stock |
| P-855009230 | Toronto Research | In stock | 90 | As a main component | in stock |
| P-855009231 | Toronto Research | In stock | 90 | As a main component | in stock |
| P-617723420 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As a main component | 1.908 g |
| P-617790124 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As a main component | 1.908 g |
| P-580088061 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 181.231 |
| logP | 1.426 |
| H-bond acceptors | 3 |
| H-bond donors | 3 |
| Rotatable bonds | 4 |
| PSA | 52.49 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 51.8155 |
| Atoms | 28 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 15 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 |
