Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2955058744
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 | 45 USD | 90 | 21 working days | Get Quote |
| 5 mg | 53 USD | 98 | 20 working days | Get Quote |
| 10 mg | 53 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.
| Name | File |
|---|---|
| SDF | MCULE-2955058744.sdf |
| SMILES | MCULE-2955058744.smiles |
| Standard InChI | MCULE-2955058744.inchi |
| InChIKey | MCULE-2955058744.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867586872 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875745821 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869304495 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-893517292 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 136.811 g |
| P-851768318 | AmBeed | On request | N/A | As is | by synthesis |
| P-489238529 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-873291143 | Angene | Building Blocks in stock | 98 | As is | 40 g |
| P-895938944 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864180784 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-590966583 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
| P-887223895 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-580433160 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-889294210 | FluoroChem | General BB | 97 | As is | in stock |
| P-502504703 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-454410087 | Key Organics | Building Blocks | 95 | As is | 1.166 g |
| P-18740062 | Key Organics | Screening Compounds and Fragments | 95 | As is | 1.166 g |
| P-872525398 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-620087809 | Otava | In-House Stock Library | 90 | As is | 1000 mg |
| P-620226578 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 1000 mg |
| P-888863783 | PharmaBlock | In stock | N/A | As is | in stock |
| P-23343161 | TimTec | ActiMol 6 Week | 90 | As is | in stock |
| P-502383998 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-855227277 | Toronto Research | In stock | 90 | As is | in stock |
| P-893943944 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 263.717 |
| logP | 3.6817 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 3 |
| PSA | 39.19 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 72.7715 |
| Atoms | 32 |
| Rings | 2 |
| Heavy atoms | 18 |
| 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 |
