Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2922185698
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 | 7 USD | 99 | 20 working days | Get Quote |
| 5 mg | 7 USD | 99 | 20 working days | Get Quote |
| 10 mg | 7 USD | 99 | 20 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.
| Name | File |
|---|---|
| SDF | MCULE-2922185698.sdf |
| SMILES | MCULE-2922185698.smiles |
| Standard InChI | MCULE-2922185698.inchi |
| InChIKey | MCULE-2922185698.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867582714 | A2B Chem | Predominantly Building Block in stock | 99 | As is | in stock |
| P-875741294 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-588247930 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-425207755 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-489163187 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-489135215 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596953194 | Angene | Building Blocks in stock | 99 | As is | 1.03 kg |
| P-494328981 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864184639 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-590637281 | BLD pharm | In-stock building blocks | 99 | As is | 100 g |
| P-448678552 | ChemDiv | Discovery Chemistry Library | 90 | As is | 131 mg |
| P-851266136 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868597723 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-580303313 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-862011380 | FluoroChem | General BB | N/A | As is | in stock |
| P-870656218 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-502765651 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-502553038 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-503147795 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
| P-596564845 | Key Organics | Building Blocks | 97 | As is | 100 g |
| P-855994556 | Key Organics | Screening Compounds and Fragments | 97 | As is | 100 mg |
| P-31256932 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-860794226 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-854755761 | MedChemExpress | In stock Building Blocks | 95 | As is | in stock |
| P-12355469 | Otava | In-House Stock Library | 90 | As is | 2.574 g |
| P-500406685 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-19281370 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885533744 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-596764335 | Synthonix | In-stock Building Blocks | 99 | As is | 1.87408 kg |
| P-502372859 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611482049 | Toronto Research | In stock | 90 | As is | in stock |
| P-35092708 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 128 mg |
| P-615408293 | eNovation Chemicals LLC | Building Blocks in stock | 99 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 183.161 |
| logP | 2.1352 |
| H-bond acceptors | 5 |
| H-bond donors | 0 |
| Rotatable bonds | 3 |
| PSA | 64.28 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 48.248 |
| Atoms | 22 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 9 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| 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 |
