Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8145037181-0
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 | 6 USD | N/A | 9 working days | Get Quote |
| 5 mg | 6 USD | N/A | 9 working days | Get Quote |
| 10 mg | 6 USD | N/A | 9 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-8145037181-0.sdf |
| SMILES | MCULE-8145037181-0.smiles |
| Standard InChI | MCULE-8145037181-0.inchi |
| InChIKey | MCULE-8145037181-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867570664 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875731282 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869194992 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-590380571 | AK Scientific | Building Blocks | 99 | As is | in stock |
| P-517094124 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-606927857 | AmBeed | In stock | N/A | As is | in stock |
| P-489171984 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596949462 | Angene | Building Blocks in stock | 99 | As is | 525 g |
| P-866729347 | Apollo Scientific | In Stock | 95 | As is | 844 g |
| P-864206913 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-893262021 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-868613245 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-893288992 | HTS Biochemie Innovationen GmbH | PROTAC | 90 | As is | in stock |
| P-890203044 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | 100 mg |
| P-855932699 | Key Organics | Building Blocks | 97 | As is | 25 g |
| P-579666216 | LabSeeker, Inc | On demand Catalog | 99 | As is | by resynthesis (? - ? days) |
| P-856040339 | LaboTest | Building Blocks | 90 | As is | 10 g |
| P-31273017 | LaboTest | Screening Collection | 90 | As is | 5 g |
| P-611662581 | Manchester Organics | Stock compounds | 95 | As is | 10 g |
| P-863711361 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-889880856 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-502368068 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-888578361 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-611467074 | Toronto Research | In stock | 90 | As is | in stock |
| P-666974868 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 187.061 |
| logP | 1.4972 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 7 |
| PSA | 18.46 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 42.718 |
| Atoms | 22 |
| Rings | 0 |
| Heavy atoms | 10 |
| Hydrogen atoms | 12 |
| Heteroatoms | 4 |
| N/O atoms | 2 |
| 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 |
