Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6444716880
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 | 6 USD | 98 | 20 working days | Get Quote |
| 5 mg | 6 USD | 98 | 20 working days | Get Quote |
| 10 mg | 6 USD | 98 | 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.
-
1
MCULE-9697304880
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-6444716880.sdf |
| SMILES | MCULE-6444716880.smiles |
| Standard InChI | MCULE-6444716880.inchi |
| InChIKey | MCULE-6444716880.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867588570 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875747728 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-597026365 | AEchem | Building blocks | 95 | As is | in stock |
| P-580237951 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
| P-617324666 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-606850321 | AmBeed | In stock | N/A | As is | in stock |
| P-489143454 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596989144 | Angene | Building Blocks in stock | 98 | As is | 200 g |
| P-864085500 | AstaTech | In Stock BBs | 97 | As is | in stock |
| P-606956125 | BLD pharm | In-stock building blocks | 98 | As is | 760 g |
| P-851247054 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868576926 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-580428596 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-580272882 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-861927503 | FluoroChem | General BB | 98 | As is | in stock |
| P-870648386 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-505510329 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-675293786 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-454412185 | Key Organics | Building Blocks | 97 | As is | 100 g |
| P-855995584 | Key Organics | Screening Compounds and Fragments | 97 | As is | 100 mg |
| P-31258690 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-31177772 | LaboTest | Screening Collection | 90 | As is | 2 g |
| P-856042132 | LaboTest | Building Blocks | 90 | As is | 2 g |
| P-613276193 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-580489552 | Manchester Organics | Compounds on demand | 97 | As is | by synthesis |
| P-852443669 | Matrix Scientific | All | N/A | As is | in stock |
| P-593105587 | Otava | Virtual BB | 95 | As is | by synthesis |
| P-620224774 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 1000 mg |
| P-620070225 | Otava | In-House Stock Library | 90 | As is | 1000 mg |
| P-500401105 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-885546355 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-892263470 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892344783 | TargetMol | Screening Compounds - stock amount | 95 | As is | unavailable |
| P-502328947 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611380067 | Toronto Research | In stock | 90 | As is | in stock |
| P-580086963 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-867588569 | A2B Chem | Predominantly Building Block in stock | 98 | Main component | in stock |
| P-875747727 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-869191820 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-505351793 | AK Scientific | Building Blocks | 98 | Main component | in stock |
| P-893337567 | Aldlab Chemicals | Building Block Custom Synth | 95 | Main component | by synthesis |
| P-606861727 | AmBeed | In stock | N/A | Main component | in stock |
| P-489155186 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | Main component | in stock |
| P-596955326 | Angene | Building Blocks in stock | 98 | Main component | 100 g |
| P-494333238 | Apollo Scientific | On request | 95 | Main component | by resynthesis (? - ? days) |
| P-864110082 | AstaTech | In Stock BBs | 95 | Main component | in stock |
| P-580709887 | BLD pharm | In-stock building blocks | 98 | Main component | 2.28 kg |
| P-851246398 | Chemshuttle | On request catalog | 95 | Main component | by synthesis |
| P-861284986 | Chiralstar | Chiralstar Building Blocks | 95 | Main component | in stock |
| P-868577061 | Combi-Blocks | Building Block in stock | 98 | Main component | in stock |
| P-580403117 | Debye Scientific | General Catalog | 95 | Main component | by resynthesis (? - ? days) |
| P-862000823 | FluoroChem | General BB | 98 | Main component | in stock |
| P-505519209 | Hangzhou Apichem | Building Blocks in stock | 95 | Main component | in stock |
| P-502528889 | Innovapharm | Virtual Building Blocks | 95 | Main component | by synthesis |
| P-500152201 | J&W Pharmlab | In-stock compounds | 98 | Main component | in stock |
| P-454393317 | Key Organics | Building Blocks | 95 | Main component | 27.57 g |
| P-454301676 | Key Organics | Screening Compounds and Fragments | 95 | Main component | 100 mg |
| P-615645984 | LabNetwork | In stock | 95 | Main component | in stock |
| P-894995257 | LabNetwork | OTS | N/A | Main component | in stock |
| P-860797181 | LabSeeker, Inc | Stock Collection | 95 | Main component | in stock |
| P-613281741 | Life Chemicals | Building Blocks - virtual | 95 | Main component | by synthesis |
| P-580514914 | Manchester Organics | Stock compounds | 98 | Main component | 118 g |
| P-852451760 | Matrix Scientific | All | N/A | Main component | in stock |
| P-492276850 | Otava | Chemical Building Blocks for Prompt Delivery | 97 | Main component | 218 mg |
| P-26397115 | Otava | In-House Stock Library | 90 | Main component | 218 mg |
| P-500399433 | Pi Chemicals | Virtual Compounds | 98 | Main component | by synthesis |
| P-885546356 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component | by synthesis |
| P-892262381 | TargetMol | Screening Compounds - synthesis | 95 | Main component | by synthesis |
| P-892343767 | TargetMol | Screening Compounds - stock amount | 95 | Main component | unavailable |
| P-502370560 | TimTec | Building Block Collection | 90 | Main component | in stock |
| P-23112085 | TimTec | ActiMol 4 Week - On demand | 94 | Main component | by resynthesis (? - ? days) |
| P-615392244 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 201.648 |
| logP | 2.0537 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 4 |
| PSA | 49.33 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 52.5605 |
| Atoms | 25 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 12 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
