Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7780487665-0
Structure
Show compound
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 | 22 working days | Get Quote |
| 5 mg | 16 USD | 98 | 22 working days | Get Quote |
| 10 mg | 16 USD | 98 | 22 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-2481702478-0
- Component type: Main
-
1
MCULE-7981253226-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-7780487665-0.sdf |
| SMILES | MCULE-7780487665-0.smiles |
| Standard InChI | MCULE-7780487665-0.inchi |
| InChIKey | MCULE-7780487665-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-864133302 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-868544526 | Axon Medchem | Axon predominantly SC catalog | 100 | As is | in stock |
| P-893237041 | Biosynth | In Stock | 95 | As is | in stock |
| P-893219447 | Biosynth | In Stock | 95 | As is | in stock |
| P-868564294 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
| P-870581936 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
| P-505493876 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-854062612 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-524441054 | Key Organics | Biochemicals | 97 | As is | 448 mg |
| P-873389783 | LabSeeker, Inc | On demand Catalog | N/A | As is | by resynthesis (? - ? days) |
| P-131399712 | Life Chemicals | Screening Compounds | 90 | As is | 6.542 g |
| P-580510885 | Manchester Organics | Stock compounds | 95 | As is | 935 g |
| P-852522474 | Matrix Scientific | All | N/A | As is | in stock |
| P-896627384 | MedChemExpress | Screening compounds on demand | 95 | As is | by synthesis |
| P-854717299 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-881189329 | Otava | In-House Stock Library | 90 | As is | 50 mg |
| P-500371843 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-579710162 | Selleckchem | Product Catalog | N/A | As is | in stock |
| P-579708351 | Sinova Inc. | In-stock Building Blocks | N/A | As is | in stock |
| P-869107895 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892286484 | TargetMol | In Stock BB | 95 | As is | unavailable |
| P-888626920 | TargetMol | Screening Compounds - stock amount | 95 | As is | 148 mg |
| P-611445312 | Toronto Research | In stock | 90 | As is | in stock |
| P-867544219 | A2B Chem | Predominantly Building Block in stock | 95 | Main component | in stock |
| P-875701562 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-881662805 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-588247059 | AK Scientific | Building Blocks | 98 | Main component | in stock |
| P-675063085 | Alinda | Stock Screening Compounds | 90 | Main component | in stock |
| P-875896446 | Allbio Pharm | In stock | N/A | Main component | in stock |
| P-851150732 | Angene | Building Blocks in stock | 95 | Main component | 25 g |
| P-893237040 | Biosynth | In Stock | 95 | Main component | in stock |
| P-893219446 | Biosynth | In Stock | 95 | Main component | in stock |
| P-868595352 | Combi-Blocks | Building Block in stock | 98 | Main component | in stock |
| P-579481628 | DC Chemicals Limited | Stock Products | 95 | Main component | in stock |
| P-505492705 | Hangzhou Apichem | Building Blocks in stock | 95 | Main component | in stock |
| P-579626804 | LabSeeker, Inc | Stock Collection | 98 | Main component | in stock |
| P-675204462 | Life Chemicals | Screening Compounds | 90 | Main component | 265 mg |
| P-854716803 | MedChemExpress | Screening compounds In stock | 95 | Main component | in stock |
| P-579712028 | Selleckchem | Product Catalog | N/A | Main component | in stock |
| P-579704044 | Sinova Inc. | In-stock Building Blocks | N/A | Main component | in stock |
| P-888603019 | TimTec | ActiMol 4 Week - On demand | 94 | Main component | by resynthesis (? - ? days) |
| P-611445311 | Toronto Research | In stock | 90 | Main component | in stock |
| P-893136964 | A2B Chem | Predominantly Building Block on demand | N/A | Main component as a main component | by synthesis |
| P-867619431 | A2B Chem | Predominantly Building Block in stock | 98 | Main component as a main component | in stock |
| P-875781075 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-869246216 | AK Scientific | Building Blocks | 95 | Main component as a main component | in stock |
| P-606914573 | AmBeed | In stock | N/A | Main component as a main component | in stock |
| P-872725678 | Apexbio Technology | Bioactive Compound Library | 98 | Main component as a main component | in stock |
| P-896034127 | AstaTech | Backordered BBs | 98 | Main component as a main component | by synthesis |
| P-893281724 | BLD pharm | Non-stock building blocks | 98 | Main component as a main component | by synthesis |
| P-861371807 | Combi-Blocks | Building Block on demand | 95 | Main component as a main component | by synthesis |
| P-579481627 | DC Chemicals Limited | Stock Products | 95 | Main component as a main component | in stock |
| P-855924525 | Key Organics | Building Blocks | 97 | Main component as a main component | 250 mg |
| P-863734903 | MedChemExpress | Screening compounds on demand | 95 | Main component as a main component | by synthesis |
| P-888171648 | Molnova | On demand | 98 | Main component as a main component | by synthesis |
| P-579712027 | Selleckchem | Product Catalog | N/A | Main component as a main component | in stock |
| P-525185906 | TargetMol | Screening Compounds - synthesis | 95 | Main component as a main component | by synthesis |
| P-892298099 | TargetMol | In Stock BB | 95 | Main component as a main component | unavailable |
| P-888657987 | TargetMol | Screening Compounds - stock amount | 95 | Main component as a main component | 150 mg |
| P-872753522 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 666.702 |
| logP | 1.319 |
| H-bond acceptors | 17 |
| H-bond donors | 5 |
| Rotatable bonds | 12 |
| PSA | 253.93 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 172.0269 |
| Atoms | 84 |
| Rings | 4 |
| Heavy atoms | 46 |
| Hydrogen atoms | 38 |
| Heteroatoms | 18 |
| N/O atoms | 17 |
| 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 |
