Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9421024216
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 | 10 USD | 95 | 8 working days | Get Quote |
| 5 mg | 10 USD | 95 | 8 working days | Get Quote |
| 10 mg | 10 USD | 95 | 8 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-9421024216.sdf |
| SMILES | MCULE-9421024216.smiles |
| Standard InChI | MCULE-9421024216.inchi |
| InChIKey | MCULE-9421024216.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867554829 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875713569 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-890254227 | ACS Scientific | Synthesis catalog | 97 | As is | by synthesis |
| P-590401007 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-903040459 | Aaron Chemicals LLC | Predominantly Building Block | 98 | As is | 50 g |
| P-905502639 | Accela ChemBio | On demand | 97 | As is | by synthesis |
| P-610971934 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 607.936 g |
| P-606840604 | AmBeed | In stock | N/A | As is | in stock |
| P-489185280 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596942917 | Angene | Building Blocks in stock | 98 | As is | 50 g |
| P-494338271 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864101771 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-580700941 | BLD pharm | In-stock building blocks | 95 | As is | 11.25 g |
| P-901566332 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-505596460 | Chemcia | Stock compounds | 95 | As is | in stock |
| P-851244363 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-861278446 | Chiralstar | Chiralstar Building Blocks | 95 | As is | in stock |
| P-868603998 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
| P-580289628 | Debye Scientific | General Catalog | N/A | As is | by resynthesis (? - ? days) |
| P-862022411 | FluoroChem | China Stock BB | 95 | As is | 89.9 g |
| P-905343890 | FluoroChem | German Stock BB | 95 | As is | 750 mg |
| P-888313058 | Frontier Specialty Chemicals Inc | All products | N/A | As is | in stock |
| P-563384354 | Key Organics | Building Blocks | 95 | As is | 5 g |
| P-579624526 | LabSeeker, Inc | Stock Collection | 95 | As is | 50 g |
| P-31258072 | LaboTest | Screening Collection | 90 | As is | 100 mg |
| P-852503070 | Matrix Scientific | All | N/A | As is | in stock |
| P-854756076 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-888866984 | PharmaBlock | In stock | N/A | As is | in stock |
| P-889868850 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-873282157 | Shanghai iChemical | In stock | N/A | As is | in stock |
| P-596748094 | Synthonix | In-stock Building Blocks | 95 | As is | 12.7 g |
| P-906815102 | Titan Scientific | Predominantly Building Block on demand | 98 | As is | by synthesis |
| P-611413953 | Toronto Research | In stock | 90 | As is | in stock |
| P-886921631 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 222.240 |
| logP | 2.3141 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 5 |
| PSA | 68.29 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 59.8702 |
| Atoms | 30 |
| Rings | 1 |
| Heavy atoms | 16 |
| Hydrogen atoms | 14 |
| 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 |
