Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5253943571
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 | 97 | 14 working days | Get Quote |
| 5 mg | 7 USD | 97 | 14 working days | Get Quote |
| 10 mg | 7 USD | 97 | 14 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-5253943571.sdf |
| SMILES | MCULE-5253943571.smiles |
| Standard InChI | MCULE-5253943571.inchi |
| InChIKey | MCULE-5253943571.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-903039446 | Aaron Chemicals LLC | Predominantly Building Block | 97 | As is | 500 g |
| P-610978014 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 809.65 g |
| P-489222056 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-589656088 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-584629843 | BLD pharm | In-stock building blocks | 95 | As is | 152.25 g |
| P-505593212 | Chemcia | Stock compounds | 97 | As is | in stock |
| P-851266549 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868645859 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
| P-901372305 | FluoroChem | In Stock BB | N/A | As is | 10 g |
| P-904063997 | MedChemExpress | Screening compounds on demand | 95 | As is | by synthesis |
| P-854693905 | MedChemExpress | Natural Products In stock | 95 | As is | in stock |
| P-873282216 | Shanghai iChemical | In stock | N/A | As is | in stock |
| P-901186119 | AA Blocks | AA Blocks - synthesis | N/A | As an isomer | by synthesis |
| P-881661996 | AK Scientific | Building Blocks | 95 | As an isomer | in stock |
| P-590378955 | AK Scientific | Building Blocks | 98 | As an isomer | in stock |
| P-874630744 | AK Scientific | Building Blocks | 98 | As an isomer | in stock |
| P-903067051 | Aaron Chemicals LLC | Predominantly Building Block | 98 | As an isomer | 75 g |
| P-893518519 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As an isomer | 2.0482 kg |
| P-606925173 | AmBeed | In stock | N/A | As an isomer | in stock |
| P-489144702 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As an isomer | in stock |
| P-619198478 | Angene | Building Blocks in stock | 98 | As an isomer | unavailable |
| P-589660696 | Apollo Scientific | On request | 95 | As an isomer | by resynthesis (? - ? days) |
| P-864195812 | AstaTech | In Stock BBs | 95 | As an isomer | in stock |
| P-619603393 | BLD pharm | In-stock building blocks | 98 | As an isomer | 255 g |
| P-34883971 | Chemical Intelligence Co Limited | Stock Screening Compounds | 90 | As an isomer | in stock |
| P-868601816 | Combi-Blocks | Building Block in stock | 97 | As an isomer | in stock |
| P-862046598 | FluoroChem | General BB | N/A | As an isomer | in stock |
| P-524187950 | Key Organics | Building Blocks | 95 | As an isomer | 1000 mg |
| P-596566923 | Key Organics | Building Blocks | 97 | As an isomer | 25 g |
| P-579613723 | LabSeeker, Inc | Stock Collection | 95 | As an isomer | in stock |
| P-579636443 | LabSeeker, Inc | On demand Catalog | 97 | As an isomer | by resynthesis (? - ? days) |
| P-856010428 | LaboTest | Screening Collection | 90 | As an isomer | 500 mg |
| P-613334969 | Life Chemicals | Building Blocks - virtual | 95 | As an isomer | by synthesis |
| P-901577713 | MedChemExpress | Screening compounds In stock | 95 | As an isomer | in stock |
| P-875881245 | MedKoo | In stock compounds | 95 | As an isomer | in stock |
| P-885541226 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As an isomer | by synthesis |
| P-19627716 | Princeton Biomolecular Research | Screening Compounds | 90 | As an isomer | in stock |
| P-873284346 | Shanghai iChemical | In stock | N/A | As an isomer | in stock |
| P-892262178 | TargetMol | Screening Compounds - synthesis | 95 | As an isomer | by synthesis |
| P-904251836 | TargetMol | In Stock BB | 95 | As an isomer | unavailable |
| P-892343572 | TargetMol | Screening Compounds - stock amount | 95 | As an isomer | 4.895 g |
| P-888497167 | TimTec | ActiMol 4 Week - On demand | 94 | As an isomer | by resynthesis (? - ? days) |
| P-2253446 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As an isomer | 882 mg |
| P-667017196 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As an isomer | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 132.157 |
| logP | 0.478 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 57.53 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 33.8896 |
| Atoms | 21 |
| Rings | 0 |
| Heavy atoms | 9 |
| Hydrogen atoms | 12 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
