Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1225783673-0
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 | 14 USD | N/A | 9 working days | Get Quote |
| 5 mg | 22 USD | 97 | 20 working days | Get Quote |
| 10 mg | 22 USD | 97 | 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-5393489002-0
- Component type: Main
-
1
MCULE-3549142744-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1225783673-0.sdf |
| SMILES | MCULE-1225783673-0.smiles |
| Standard InChI | MCULE-1225783673-0.inchi |
| InChIKey | MCULE-1225783673-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-489141106 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-896626890 | MedChemExpress | Screening compounds on demand | 95 | As is | by synthesis |
| P-867506597 | A2B Chem | Predominantly Building Block on demand | N/A | Main component | by synthesis |
| P-500415074 | AvaChem Scientific | On demand | 95 | Main component | by synthesis |
| P-893232200 | Biosynth | In Stock | 95 | Main component | in stock |
| P-861277368 | Chiralstar | Chiralstar Building Blocks | 95 | Main component | in stock |
| P-896630855 | MedChemExpress | Screening compounds In stock | 95 | Main component | in stock |
| P-584619851 | MedKoo | In stock compounds | 95 | Main component | in stock |
| P-892256410 | TargetMol | Screening Compounds - synthesis | 95 | Main component | by synthesis |
| P-892340242 | TargetMol | Screening Compounds - stock amount | 95 | Main component | unavailable |
| P-875700848 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-851457486 | AmBeed | On request | N/A | Main component as a main component | by synthesis |
| P-606866205 | AmBeed | In stock | N/A | Main component as a main component | in stock |
| P-596939050 | Angene | Building Blocks in stock | 97 | Main component as a main component | 1000 mg |
| P-580195213 | Apexbio Technology | Bioactive Compound Library | 98 | Main component as a main component | in stock |
| P-864177109 | AstaTech | In Stock BBs | 98 | Main component as a main component | in stock |
| P-611017580 | BLD pharm | Non-stock building blocks | 95 | Main component as a main component | by synthesis |
| P-580699270 | BLD pharm | In-stock building blocks | 98 | Main component as a main component | 1.71 g |
| P-893232076 | Biosynth | In Stock | 95 | Main component as a main component | in stock |
| P-851268251 | Chemshuttle | On request catalog | 95 | Main component as a main component | by synthesis |
| P-580452440 | CliniSciences S.A.S | All products | 98 | Main component as a main component | in stock |
| P-861430534 | Combi-Blocks | Building Block on demand | 95 | Main component as a main component | by synthesis |
| P-608496807 | DC Chemicals Limited | Stock Products | 95 | Main component as a main component | in stock |
| P-870653158 | Glentham Life Sciences | Compounds typically in stock | N/A | Main component as a main component | in stock |
| P-505515957 | Hangzhou Apichem | Building Blocks in stock | 95 | Main component as a main component | in stock |
| P-524165578 | Key Organics | Building Blocks | 98 | Main component as a main component | 10 mg |
| P-579628760 | LabSeeker, Inc | Stock Collection | 96 | Main component as a main component | in stock |
| P-860794420 | Manchester Organics | Compounds on demand | N/A | Main component as a main component | by synthesis |
| P-608279035 | Molnova | Stock | 98 | Main component as a main component | in stock |
| P-500411323 | Pi Chemicals | Virtual Compounds | 97 | Main component as a main component | by synthesis |
| P-885536587 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component as a main component | by synthesis |
| P-579710680 | Selleckchem | Product Catalog | N/A | Main component as a main component | in stock |
| P-525182675 | TargetMol | Screening Compounds - synthesis | 95 | Main component as a main component | by synthesis |
| P-892297356 | TargetMol | In Stock BB | 95 | Main component as a main component | unavailable |
| P-888657629 | TargetMol | Screening Compounds - stock amount | 95 | Main component as a main component | 29 mg |
| P-611449600 | Toronto Research | In stock | 90 | Main component as a main component | in stock |
| P-886958734 | eNovation Chemicals LLC | Building Block on demand | 95 | Main component as a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 500.650 |
| logP | 5.0296 |
| H-bond acceptors | 9 |
| H-bond donors | 4 |
| Rotatable bonds | 16 |
| PSA | 152.62 |
| RO5 violations | 2 |
| RO3 violations | 6 |
| Refractivity | 135.8311 |
| Atoms | 74 |
| Rings | 1 |
| Heavy atoms | 34 |
| Hydrogen atoms | 40 |
| Heteroatoms | 10 |
| N/O atoms | 9 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 1 |
| Cis/trans stereo double bonds | 1 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
