Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1153927848
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 | 13 USD | 95 | 11 working days | Get Quote |
| 5 mg | 13 USD | 95 | 11 working days | Get Quote |
| 10 mg | 13 USD | 95 | 11 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-1153927848.sdf |
| SMILES | MCULE-1153927848.smiles |
| Standard InChI | MCULE-1153927848.inchi |
| InChIKey | MCULE-1153927848.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867575558 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875735883 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-881670728 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-590380177 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-851530736 | AmBeed | On request | N/A | As is | by synthesis |
| P-489170995 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596983378 | Angene | Building Blocks in stock | 97 | As is | 31 g |
| P-494319905 | Apollo Scientific | In Stock | 95 | As is | unavailable |
| P-864123799 | AstaTech | In Stock BBs | 97 | As is | in stock |
| P-590876796 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
| P-868642056 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
| P-580419890 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-861918681 | FluoroChem | General BB | 98 | As is | in stock |
| P-505514289 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-454352740 | Key Organics | Screening Compounds and Fragments | 90 | As is | 567 mg |
| P-579686705 | LabSeeker, Inc | On demand Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-31179782 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-856044724 | LaboTest | Building Blocks | 90 | As is | unavailable |
| P-580473691 | Manchester Organics | Compounds on demand | 97 | As is | by synthesis |
| P-852378479 | Matrix Scientific | All | N/A | As is | in stock |
| P-895256842 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-500391774 | Pi Chemicals | Virtual Compounds | 97 | As is | by synthesis |
| P-885546796 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-502372550 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611377773 | Toronto Research | In stock | 90 | As is | in stock |
| P-666974142 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 218.198 |
| logP | 3.1958 |
| H-bond acceptors | 1 |
| H-bond donors | 0 |
| Rotatable bonds | 2 |
| PSA | 17.07 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 56.2325 |
| Atoms | 24 |
| Rings | 2 |
| Heavy atoms | 16 |
| Hydrogen atoms | 8 |
| Heteroatoms | 3 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
