Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5234750418-0
Structure
Show compound
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 | 8 USD | 95 | 8 working days | Get Quote |
| 5 mg | 8 USD | 95 | 8 working days | Get Quote |
| 10 mg | 8 USD | 95 | 8 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-5234750418-0.sdf |
| SMILES | MCULE-5234750418-0.smiles |
| Standard InChI | MCULE-5234750418-0.inchi |
| InChIKey | MCULE-5234750418-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867562890 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875722433 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869195529 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505398449 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-610991143 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 1.32271 kg |
| P-580269089 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
| P-606883183 | AmBeed | In stock | N/A | As is | in stock |
| P-489176023 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596945846 | Angene | Building Blocks in stock | 95 | As is | 403.8 g |
| P-494319779 | Apollo Scientific | In Stock | 95 | As is | 96.5 g |
| P-864117155 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-584629944 | BLD pharm | In-stock building blocks | 95 | As is | 41.25 g |
| P-579721679 | CNH Technologies | In-stock Building Blocks | N/A | As is | unavailable |
| P-851271609 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-861280842 | Chiralstar | Chiralstar Building Blocks | 97 | As is | in stock |
| P-868580349 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
| P-580421741 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-889110410 | FluoroChem | In Stock BB | 97 | As is | 4.5 g |
| P-505506539 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-454352809 | Key Organics | Screening Compounds and Fragments | 90 | As is | 183 mg |
| P-608080972 | LabSeeker, Inc | Stock Collection | 95 | As is | in stock |
| P-31226666 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-580467110 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852376807 | Matrix Scientific | All | N/A | As is | in stock |
| P-854739526 | MedChemExpress | In stock Building Blocks | 95 | As is | in stock |
| P-888862322 | PharmaBlock | In stock | N/A | As is | in stock |
| P-500377140 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-885549039 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-596758261 | Synthonix | In-stock Building Blocks | 95 | As is | 499.3 g |
| P-502328892 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611368220 | Toronto Research | In stock | 90 | As is | in stock |
| P-893979102 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 208.563 |
| logP | 3.1713 |
| H-bond acceptors | 1 |
| H-bond donors | 0 |
| Rotatable bonds | 2 |
| PSA | 17.07 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 41.8415 |
| Atoms | 17 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 4 |
| Heteroatoms | 5 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 4 |
| 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 |
