Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6794591503-0
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 | 5 USD | 95 | 10 working days | Get Quote |
| 5 mg | 5 USD | 95 | 10 working days | Get Quote |
| 10 mg | 5 USD | 95 | 10 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.
-
MCULE-3110013793-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-6794591503-0.sdf |
| SMILES | MCULE-6794591503-0.smiles |
| Standard InChI | MCULE-6794591503-0.inchi |
| InChIKey | MCULE-6794591503-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867580073 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875739989 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869188175 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-608395460 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-580200432 | Aldlab Chemicals | Building Block Stock | 95 | As is | 3 g |
| P-606849444 | AmBeed | In stock | N/A | As is | in stock |
| P-489173724 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596952510 | Angene | Building Blocks in stock | 96 | As is | 1000 g |
| P-895922360 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864093428 | AstaTech | In Stock BBs | 98 | As is | in stock |
| P-889740705 | Atlantic Research Chemicals Ltd | In-stock Building Blocks | 95 | As is | 18.25 g |
| P-580699242 | BLD pharm | In-stock building blocks | 98 | As is | 773 g |
| P-851273593 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868646924 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-889115454 | FluoroChem | In Stock BB | 99 | As is | 15 g |
| P-890213136 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | As is | in stock |
| P-590335532 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | 239.3 g |
| P-524186000 | Key Organics | Building Blocks | 98 | As is | 25 g |
| P-855996260 | Key Organics | Screening Compounds and Fragments | 98 | As is | 100 mg |
| P-615648953 | LabNetwork | In stock | 95 | As is | in stock |
| P-579614829 | LabSeeker, Inc | Stock Collection | 97 | As is | in stock |
| P-31189384 | LaboTest | Screening Collection | 90 | As is | 500 mg |
| P-869011157 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-852426145 | Matrix Scientific | All | N/A | As is | in stock |
| P-428002273 | Maybridge | Screening Collection | 90 | As is | 84.1 kg |
| P-854735896 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-875884015 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-500403129 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-859991460 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-596748184 | Synthonix | In-stock Building Blocks | 98 | As is | 6.148 kg |
| P-615437784 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-895720483 | MedChemExpress | Building Blocks on demand | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 208.257 |
| logP | 3.27 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 4 |
| PSA | 64.35 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 61.0921 |
| Atoms | 31 |
| Rings | 1 |
| Heavy atoms | 15 |
| Hydrogen atoms | 16 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 |
