Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9224566071
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 | 153 USD | 95 | 25 working days | Get Quote |
| 5 mg | 153 USD | 95 | 25 working days | Get Quote |
| 10 mg | 153 USD | 95 | 25 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-5004731894
- Component type: Main
-
MCULE-3851029411
- Component type: Main
-
MCULE-4453781453
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-9224566071.sdf |
| SMILES | MCULE-9224566071.smiles |
| Standard InChI | MCULE-9224566071.inchi |
| InChIKey | MCULE-9224566071.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-851545222 | AmBeed | On request | N/A | As is | by synthesis |
| P-590868919 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-851292218 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-580441019 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-500179896 | J&W Pharmlab | In-stock compounds | 96 | As is | in stock |
| P-864074410 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-667011180 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-889900941 | AA Blocks | AA Blocks - synthesis | N/A | As a main component | by synthesis |
| P-853426055 | AK Scientific | Building Blocks | 98 | As a main component | in stock |
| P-851705093 | AmBeed | On request | N/A | As a main component | by synthesis |
| P-851722166 | AmBeed | On request | N/A | As a main component | by synthesis |
| P-489184477 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As a main component | in stock |
| P-864225912 | AstaTech | Backordered BBs | 95 | As a main component | by synthesis |
| P-591029575 | BLD pharm | Non-stock building blocks | 96 | As a main component | by synthesis |
| P-590928139 | BLD pharm | Non-stock building blocks | 97 | As a main component | by synthesis |
| P-851283548 | Chemshuttle | On request catalog | 95 | As a main component | by synthesis |
| P-851292217 | Chemshuttle | On request catalog | 95 | As a main component | by synthesis |
| P-861282464 | Chiralstar | Chiralstar Building Blocks | 97 | As a main component | in stock |
| P-889033410 | Combi-Blocks | Building Block on demand | 95 | As a main component | by synthesis |
| P-862038745 | FluoroChem | General BB | N/A | As a main component | in stock |
| P-500179897 | J&W Pharmlab | In-stock compounds | 96 | As a main component | in stock |
| P-855946336 | Key Organics | Building Blocks | 95 | As a main component | 5 g |
| P-854919048 | MedChemExpress | Building Blocks on demand | 95 | As a main component | by synthesis |
| P-611379264 | Toronto Research | In stock | 90 | As a main component | in stock |
| P-615466557 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 188.229 |
| logP | 1.6732 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 67.59 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 54.2991 |
| Atoms | 26 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 12 |
| 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 |
