Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3981568977
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 | 13 USD | 95 | 9 working days | Get Quote |
| 5 mg | 13 USD | 95 | 9 working days | Get Quote |
| 10 mg | 13 USD | 95 | 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.
-
1
MCULE-6193759278
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-3981568977.sdf |
| SMILES | MCULE-3981568977.smiles |
| Standard InChI | MCULE-3981568977.inchi |
| InChIKey | MCULE-3981568977.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-492322820 | Advamacs (TriMen Chemicals) | Predominantly Building Blocks in stock | 95 | As is | in stock |
| P-851905305 | AmBeed | On request | N/A | As is | by synthesis |
| P-611103040 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-862053590 | FluoroChem | General BB | N/A | As is | in stock |
| P-867597303 | A2B Chem | Predominantly Building Block in stock | 95 | Main component | in stock |
| P-875755789 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-590360570 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-866102338 | Advanced Chemical Intermediates (ACI) | ACI predominantly BB catalog | 95 | Main component | unavailable |
| P-517102269 | Alinda | Stock Screening Compounds | 90 | Main component | in stock |
| P-875897166 | Allbio Pharm | In stock | N/A | Main component | in stock |
| P-606919869 | AmBeed | In stock | N/A | Main component | in stock |
| P-489159506 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | Main component | in stock |
| P-596958516 | Angene | Building Blocks in stock | 95 | Main component | 65.099 g |
| P-494337595 | Apollo Scientific | On request | 95 | Main component | by resynthesis (? - ? days) |
| P-864122496 | AstaTech | In Stock BBs | 95 | Main component | in stock |
| P-580713300 | BLD pharm | In-stock building blocks | 95 | Main component | 2.45 g |
| P-851266378 | Chemshuttle | On request catalog | 95 | Main component | by synthesis |
| P-868623382 | Combi-Blocks | Building Block in stock | 97 | Main component | in stock |
| P-881677844 | EDASA Scientific Limited | Synthesis Building Blocks | N/A | Main component | by resynthesis (? - ? days) |
| P-862046669 | FluoroChem | General BB | N/A | Main component | in stock |
| P-675213866 | Hangzhou Apichem | Building Blocks in stock | 95 | Main component | in stock |
| P-869377468 | Matrix Scientific | All | N/A | Main component | in stock |
| P-854745723 | MedChemExpress | In stock Building Blocks | 95 | Main component | in stock |
| P-12391241 | Otava | In-House Stock Library | 90 | Main component | 1.968 g |
| P-492274382 | Otava | Chemical Building Blocks for Prompt Delivery | 99 | Main component | 1.968 g |
| P-888866203 | PharmaBlock | In stock | N/A | Main component | in stock |
| P-491305323 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component | by synthesis |
| P-596737169 | Synthonix | In-stock Building Blocks | 95 | Main component | 75.399 g |
| P-873229313 | TimTec | Building Block Collection | 90 | Main component | in stock |
| P-888586177 | TimTec | ActiMol 4 Week - On demand | 94 | Main component | by resynthesis (? - ? days) |
| P-611371423 | Toronto Research | In stock | 90 | Main component | in stock |
| P-615453325 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 186.594 |
| logP | 2.0865 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 0 |
| PSA | 72.02 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 48.2041 |
| Atoms | 19 |
| Rings | 2 |
| Heavy atoms | 12 |
| Hydrogen atoms | 7 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
