Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2083635372-0
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 | 8 USD | N/A | 9 working days | Get Quote |
| 5 mg | 8 USD | N/A | 9 working days | Get Quote |
| 10 mg | 8 USD | N/A | 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-9743706233-0
- Component type: Main
-
1
MCULE-8295936189-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-2083635372-0.sdf |
| SMILES | MCULE-2083635372-0.smiles |
| Standard InChI | MCULE-2083635372-0.inchi |
| InChIKey | MCULE-2083635372-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-852199399 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-853425983 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-851718807 | AmBeed | On request | N/A | As is | by synthesis |
| P-489164901 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-590913318 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
| P-500158640 | J&W Pharmlab | In-stock compounds | 97 | As is | in stock |
| P-854940237 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-611485445 | Toronto Research | In stock | 90 | As is | in stock |
| P-615464539 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-867648156 | A2B Chem | Predominantly Building Block in stock | 95 | Main component | in stock |
| P-875815940 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-590393943 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-851937665 | AmBeed | In stock | N/A | Main component | in stock |
| P-596985598 | Angene | Building Blocks in stock | 98 | Main component | 30 g |
| P-494350603 | Apollo Scientific | In Stock | 95 | Main component | 500 mg |
| P-864104127 | AstaTech | In Stock BBs | 95 | Main component | in stock |
| P-851264646 | Chemshuttle | On request catalog | 95 | Main component | by synthesis |
| P-861414980 | Combi-Blocks | Building Block on demand | 95 | Main component | by synthesis |
| P-575337215 | EvoBlocks | In-stock Building Blocks | 95 | Main component | in stock |
| P-861985325 | FluoroChem | General BB | N/A | Main component | in stock |
| P-14042768 | InFarmatik | Building Blocks | 90 | Main component | no data |
| P-500158639 | J&W Pharmlab | In-stock compounds | 97 | Main component | in stock |
| P-454407885 | Key Organics | Building Blocks | 95 | Main component | 23.509 g |
| P-18820475 | Key Organics | Screening Compounds and Fragments | 95 | Main component | 23.509 g |
| P-580516567 | Manchester Organics | Stock compounds | 95 | Main component | 4 g |
| P-852426624 | Matrix Scientific | All | N/A | Main component | in stock |
| P-895256080 | MedChemExpress | Building Blocks on demand | 95 | Main component | by synthesis |
| P-888882027 | PharmaBlock | In stock | N/A | Main component | in stock |
| P-885533254 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component | by synthesis |
| P-502397122 | TimTec | Building Block Collection | 90 | Main component | in stock |
| P-611588937 | Toronto Research | In stock | 90 | Main component | in stock |
| P-854650928 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component | in stock |
| P-886727670 | A2B Chem | Predominantly Building Block in stock | 95 | Main component as a main component | in stock |
| P-890026413 | AA Blocks | AA Blocks - synthesis | N/A | Main component as a main component | by synthesis |
| P-869320545 | AK Scientific | Building Blocks | 95 | Main component as a main component | in stock |
| P-893483929 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | Main component as a main component | 30 g |
| P-851802602 | AmBeed | On request | N/A | Main component as a main component | by synthesis |
| P-590979410 | BLD pharm | Non-stock building blocks | 95 | Main component as a main component | by synthesis |
| P-901542880 | Biosynth | Synthesis | 95 | Main component as a main component | by synthesis |
| P-861384363 | Combi-Blocks | Building Block on demand | 95 | Main component as a main component | by synthesis |
| P-893795949 | eNovation Chemicals LLC | Building Block on demand | 95 | Main component as a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 252.309 |
| logP | 1.6776 |
| H-bond acceptors | 5 |
| H-bond donors | 3 |
| Rotatable bonds | 2 |
| PSA | 70.59 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 77.1402 |
| Atoms | 38 |
| Rings | 2 |
| Heavy atoms | 18 |
| Hydrogen atoms | 20 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
