Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1741616711-1
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 | 1 USD | 98 | 19 working days | Get Quote |
| 5 mg | 1 USD | 98 | 19 working days | Get Quote |
| 10 mg | 1 USD | 98 | 19 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.
-
1
MCULE-1546201217-1
- Component type: Main
-
1
MCULE-1504889908-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1741616711-1.sdf |
| SMILES | MCULE-1741616711-1.smiles |
| Standard InChI | MCULE-1741616711-1.inchi |
| InChIKey | MCULE-1741616711-1.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867557755 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875717449 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869184939 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505392336 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-617064163 | Allbio Pharm | In stock | N/A | As is | in stock |
| P-606842279 | AmBeed | In stock | N/A | As is | in stock |
| P-887312646 | AmBeed | On request | N/A | As is | by synthesis |
| P-596927444 | Angene | Building Blocks in stock | 95 | As is | 5 kg |
| P-866729758 | Apollo Scientific | In Stock | 95 | As is | 39 g |
| P-864125504 | AstaTech | In Stock BBs | 97 | As is | in stock |
| P-890232268 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
| P-580697338 | BLD pharm | In-stock building blocks | 98 | As is | 630 g |
| P-900267249 | BOC Sciences | All products | N/A | As is | by resynthesis (? - ? days) |
| P-580450590 | CliniSciences S.A.S | All products | 98 | As is | in stock |
| P-868639509 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
| P-862012575 | FluoroChem | General BB | N/A | As is | in stock |
| P-500417016 | Glentham Life Sciences | Compounds maintained in stock | 98 | As is | in stock |
| P-579621192 | LabSeeker, Inc | Stock Collection | 95 | As is | in stock |
| P-852460640 | Matrix Scientific | All | N/A | As is | in stock |
| P-854691252 | MedChemExpress | Natural Products In stock | 95 | As is | in stock |
| P-619672511 | Molnova | Stock | 98 | As is | in stock |
| P-617402448 | Selleckchem | Product Catalog | N/A | As is | in stock |
| P-596736285 | Synthonix | In-stock Building Blocks | 95 | As is | 6.045 kg |
| P-594273710 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892295319 | TargetMol | In Stock BB | 95 | As is | unavailable |
| P-892337720 | TargetMol | Screening Compounds - stock amount | 95 | As is | 198 mg |
| P-611350919 | Toronto Research | In stock | 90 | As is | in stock |
| P-854966658 | Toronto Research | In stock | 90 | As is | in stock |
| P-854966674 | Toronto Research | In stock | 90 | As is | in stock |
| P-575298848 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-867401809 | A2B Chem | Predominantly Building Block on demand | 98 | Main component | by synthesis |
| P-893428391 | Advanced ChemBlocks Inc (AChemBlock) | On demand | 90 | Main component | by synthesis |
| P-851755716 | AmBeed | On request | N/A | Main component | by synthesis |
| P-889461842 | AstaTech | Backordered BBs | 97 | Main component | by synthesis |
| P-591068953 | BLD pharm | Non-stock building blocks | 97 | Main component | by synthesis |
| P-580436337 | Debye Scientific | General Catalog | 95 | Main component | by resynthesis (? - ? days) |
| P-579622756 | LabSeeker, Inc | Stock Collection | 98 | Main component | in stock |
| P-869161250 | TargetMol | Screening Compounds - synthesis | 95 | Main component | by synthesis |
| P-888656486 | TargetMol | Screening Compounds - stock amount | 95 | Main component | unavailable |
| P-867566086 | A2B Chem | Predominantly Building Block in stock | 95 | Main component as a main component | in stock |
| P-875725654 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-590396354 | AK Scientific | Building Blocks | 95 | Main component as a main component | in stock |
| P-893518881 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | Main component as a main component | 186.4 g |
| P-606925893 | AmBeed | In stock | N/A | Main component as a main component | in stock |
| P-851718321 | AmBeed | On request | N/A | Main component as a main component | by synthesis |
| P-489215328 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | Main component as a main component | in stock |
| P-596929271 | Angene | Building Blocks in stock | 95 | Main component as a main component | 50 g |
| P-866723782 | Apollo Scientific | On request | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-864090583 | AstaTech | In Stock BBs | 97 | Main component as a main component | in stock |
| P-864214735 | AstaTech | Backordered BBs | 95 | Main component as a main component | by synthesis |
| P-616195916 | BLD pharm | Non-stock building blocks | 97 | Main component as a main component | by synthesis |
| P-580725232 | BLD pharm | In-stock building blocks | 95 | Main component as a main component | 42.25 g |
| P-868607011 | Combi-Blocks | Building Block in stock | 97 | Main component as a main component | in stock |
| P-868629501 | Combi-Blocks | Building Block in stock | 97 | Main component as a main component | in stock |
| P-580436841 | Debye Scientific | General Catalog | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-901379210 | FluoroChem | In Stock BB | N/A | Main component as a main component | 5 g |
| P-862051734 | FluoroChem | General BB | N/A | Main component as a main component | in stock |
| P-505536064 | Hangzhou Apichem | Building Blocks in stock | 95 | Main component as a main component | in stock |
| P-615657245 | LabNetwork | In stock | 95 | Main component as a main component | in stock |
| P-852463942 | Matrix Scientific | All | N/A | Main component as a main component | in stock |
| P-854743705 | MedChemExpress | Building Blocks in stock | 95 | Main component as a main component | in stock |
| P-895524922 | MedChemExpress | Building Blocks on demand | 95 | Main component as a main component | by synthesis |
| P-596736776 | Synthonix | In-stock Building Blocks | 95 | Main component as a main component | 259.75 g |
| P-666981884 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 228.273 |
| logP | 1.5276 |
| H-bond acceptors | 8 |
| H-bond donors | 6 |
| Rotatable bonds | 5 |
| PSA | 170.9 |
| RO5 violations | 1 |
| RO3 violations | 4 |
| Refractivity | 52.1778 |
| Atoms | 30 |
| Rings | 0 |
| Heavy atoms | 14 |
| Hydrogen atoms | 16 |
| Heteroatoms | 9 |
| N/O atoms | 8 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
