Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1086276390
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 | 7 USD | 97 | 16 working days | Get Quote |
| 5 mg | 7 USD | 97 | 16 working days | Get Quote |
| 10 mg | 7 USD | 97 | 16 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-1086276390.sdf |
| SMILES | MCULE-1086276390.smiles |
| Standard InChI | MCULE-1086276390.inchi |
| InChIKey | MCULE-1086276390.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867540289 | A2B Chem | Predominantly Building Block in stock | 97 | As is | in stock |
| P-875696940 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869183146 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505392431 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-606837140 | AmBeed | In stock | N/A | As is | in stock |
| P-489162283 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596937951 | Angene | Building Blocks in stock | 97 | As is | 1.94 kg |
| P-552040529 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864160912 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-590629828 | BLD pharm | In-stock building blocks | 97 | As is | 156 g |
| P-868646315 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
| P-580443310 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-862094586 | FluoroChem | General BB | N/A | As is | in stock |
| P-870662940 | Glentham Life Sciences | Compounds maintained in stock | 98 | As is | in stock |
| P-505508548 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-524165621 | Key Organics | Building Blocks | 97 | As is | 24.993 g |
| P-855992891 | Key Organics | Screening Compounds and Fragments | 97 | As is | 24.993 g |
| P-608097760 | LabSeeker, Inc | Stock Collection | 95 | As is | in stock |
| P-31141396 | LaboTest | Screening Collection | 90 | As is | 10 g |
| P-856044276 | LaboTest | Building Blocks | 90 | As is | 10 g |
| P-588255514 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852604450 | Matrix Scientific | All | N/A | As is | in stock |
| P-428001716 | Maybridge | Screening Collection | 95 | As is | 8.89 kg |
| P-500371459 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-19549877 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885516613 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-22823970 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-502333178 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611383259 | Toronto Research | In stock | 90 | As is | in stock |
| P-1070966 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 88.992 g |
| P-480229042 | eNovation Chemicals LLC | Building Blocks in stock | 97 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 173.167 |
| logP | 2.9433 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 49.66 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 51.426 |
| Atoms | 20 |
| Rings | 2 |
| Heavy atoms | 13 |
| Hydrogen atoms | 7 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 |
