Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8273392972-0
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 | 98 | 20 working days | Get Quote |
| 5 mg | 8 USD | 98 | 20 working days | Get Quote |
| 10 mg | 8 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-8273392972-0.sdf |
| SMILES | MCULE-8273392972-0.smiles |
| Standard InChI | MCULE-8273392972-0.inchi |
| InChIKey | MCULE-8273392972-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867563476 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875723136 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-590379927 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-881671948 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-606938840 | AmBeed | In stock | N/A | As is | in stock |
| P-489193455 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596946107 | Angene | Building Blocks in stock | 98 | As is | 3.062 kg |
| P-585299097 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864117118 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-868649235 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-580301678 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-861966419 | FluoroChem | General BB | 97 | As is | in stock |
| P-590341410 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | 27 g |
| P-890218964 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | As is | in stock |
| P-492242886 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-502509098 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-596562607 | Key Organics | Building Blocks | 97 | As is | 10 g |
| P-855994470 | Key Organics | Screening Compounds and Fragments | 97 | As is | 100 mg |
| P-579619981 | LabSeeker, Inc | Stock Collection | 95 | As is | in stock |
| P-31251007 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-613276698 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-860796849 | Manchester Organics | Stock compounds | 97 | As is | 500 g |
| P-852380057 | Matrix Scientific | All | N/A | As is | in stock |
| P-854737705 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-519886469 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-859995229 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-596770686 | Synthonix | In-stock Building Blocks | 95 | As is | 234.769 g |
| P-869126329 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-888639725 | TargetMol | Screening Compounds - stock amount | 95 | As is | unavailable |
| P-611443321 | Toronto Research | In stock | 90 | As is | in stock |
| P-615391971 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 121.179 |
| logP | 2.4124 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 26.02 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 40.6194 |
| Atoms | 20 |
| Rings | 1 |
| Heavy atoms | 9 |
| Hydrogen atoms | 11 |
| Heteroatoms | 1 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
