Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1038310399
Compound
Show structures
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 | 35 USD | 98 | 22 working days | Get Quote |
| 5 mg | 35 USD | 98 | 22 working days | Get Quote |
| 10 mg | 35 USD | 98 | 22 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-1038310399.sdf |
| SMILES | MCULE-1038310399.smiles |
| Standard InChI | MCULE-1038310399.inchi |
| InChIKey | MCULE-1038310399.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867591032 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875750007 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-590365928 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-34859124 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-851440652 | AmBeed | On request | N/A | As is | by synthesis |
| P-489111777 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596989374 | Angene | Building Blocks in stock | 95 | As is | 7.8 g |
| P-872726460 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-864174717 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-590763180 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
| P-868596023 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
| P-580301721 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-862053399 | FluoroChem | General BB | N/A | As is | in stock |
| P-596562943 | Key Organics | Building Blocks | 95 | As is | 1000 mg |
| P-579623397 | LabSeeker, Inc | Stock Collection | 95 | As is | in stock |
| P-31175065 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-854691087 | MedChemExpress | Natural Products In stock | 95 | As is | in stock |
| P-888170973 | Molnova | On demand | 98 | As is | by synthesis |
| P-888845336 | PharmaBlock | On demand | N/A | As is | by synthesis |
| P-500401970 | Pi Chemicals | Virtual Compounds | 97 | As is | by synthesis |
| P-885545399 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-617402290 | Selleckchem | Product Catalog | N/A | As is | in stock |
| P-869176504 | TargetMol | Natural Products | 95 | As is | 590 mg |
| P-502328919 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-596709350 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 30 mg |
| P-611526231 | Toronto Research | In stock | 90 | As is | in stock |
| P-611522532 | Toronto Research | In stock | 90 | As is | in stock |
| P-615405010 | eNovation Chemicals LLC | Building Blocks in stock | 96 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 205.166 |
| logP | 1.3442 |
| H-bond acceptors | 5 |
| H-bond donors | 3 |
| Rotatable bonds | 1 |
| PSA | 90.65 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 52.7483 |
| Atoms | 22 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 7 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| 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 |
