Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2173728465
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 | 5 USD | 98 | 9 working days | Get Quote |
| 5 mg | 5 USD | 98 | 9 working days | Get Quote |
| 10 mg | 5 USD | 98 | 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.
| Name | File |
|---|---|
| SDF | MCULE-2173728465.sdf |
| SMILES | MCULE-2173728465.smiles |
| Standard InChI | MCULE-2173728465.inchi |
| InChIKey | MCULE-2173728465.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867566866 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875727186 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-890252833 | ACS Scientific | Synthesis catalog | 98 | As is | by synthesis |
| P-869186162 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505347536 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-610960543 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | unavailable |
| P-608436244 | Aldlab Chemicals | Building Block Stock | 95 | As is | 302.38 g |
| P-606906427 | AmBeed | In stock | N/A | As is | in stock |
| P-489161887 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596929579 | Angene | Building Blocks in stock | 98 | As is | 4.4517 kg |
| P-494341947 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864121078 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-580708535 | BLD pharm | In-stock building blocks | 98 | As is | 856 g |
| P-505606445 | Chemcia | Virtual compounds | 95 | As is | by synthesis |
| P-851251877 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-861271285 | Chiralstar | Chiralstar Building Blocks | 95 | As is | in stock |
| P-868611563 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-505628300 | Endotherm | Endotherm General Catalog | 95 | As is | in stock |
| P-889115862 | FluoroChem | In Stock BB | N/A | As is | 14.85 g |
| P-890218530 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | As is | in stock |
| P-590340960 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | in stock |
| P-505547400 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-454414125 | Key Organics | Building Blocks | 95 | As is | 25 g |
| P-856008363 | Key Organics | Screening Compounds and Fragments | 95 | As is | 100 mg |
| P-579628526 | LabSeeker, Inc | Stock Collection | 99 | As is | in stock |
| P-884915504 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-885398914 | Manchester Organics | Stock compounds | 95 | As is | 98 g |
| P-852503896 | Matrix Scientific | All | N/A | As is | in stock |
| P-854724368 | MedChemExpress | In stock Building Blocks | 95 | As is | in stock |
| P-12413110 | Otava | In-House Stock Library | 90 | As is | 0 mg |
| P-888868579 | PharmaBlock | In stock | N/A | As is | in stock |
| P-859995005 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-873284784 | Shanghai iChemical | In stock | N/A | As is | in stock |
| P-613816906 | Spirochem | All | 95 | As is | in stock |
| P-498667287 | Synthonix | In-stock Building Blocks | 97 | As is | 210 g |
| P-666973054 | eNovation Chemicals LLC | Building Blocks in stock | 97 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 278.350 |
| logP | 2.305 |
| H-bond acceptors | 6 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 71.69 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 85.8414 |
| Atoms | 42 |
| Rings | 2 |
| Heavy atoms | 20 |
| Hydrogen atoms | 22 |
| Heteroatoms | 6 |
| N/O atoms | 6 |
| 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 |
