Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1617590760
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 | 36 USD | 95 | 21 working days | Get Quote |
| 5 mg | 36 USD | 95 | 21 working days | Get Quote |
| 10 mg | 41 USD | 95 | 21 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-8518847103
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1617590760.sdf |
| SMILES | MCULE-1617590760.smiles |
| Standard InChI | MCULE-1617590760.inchi |
| InChIKey | MCULE-1617590760.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-615730318 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-851541694 | AmBeed | On request | N/A | As is | by synthesis |
| P-590906855 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
| P-675293343 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-31179652 | LaboTest | Screening Collection | 90 | As is | 2 g |
| P-856044374 | LaboTest | Building Blocks | 90 | As is | 2 g |
| P-852462387 | Matrix Scientific | All | N/A | As is | in stock |
| P-869062115 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-593463712 | Otava | Virtual BB | 95 | As is | by synthesis |
| P-855313670 | Toronto Research | In stock | 90 | As is | in stock |
| P-852075234 | A2B Chem | Predominantly Building Block on demand | 95 | Main component | by synthesis |
| P-867465445 | A2B Chem | Predominantly Building Block on demand | N/A | Main component | by synthesis |
| P-889906271 | AA Blocks | AA Blocks - synthesis | N/A | Main component | by synthesis |
| P-615717949 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-436463683 | Alinda | Building Blocks | 95 | Main component | 2 g |
| P-612677760 | Alinda | Stock Screening Compounds | 90 | Main component | in stock |
| P-851478090 | AmBeed | On request | N/A | Main component | by synthesis |
| P-901359485 | AstaTech | Backordered BBs | 95 | Main component | by synthesis |
| P-590864482 | BLD pharm | Non-stock building blocks | 97 | Main component | by synthesis |
| P-577174962 | ChemDiv | Building Blocks on demand | 90 | Main component | by synthesis |
| P-449227945 | ChemDiv | Discovery Chemistry Library | 90 | Main component | 17 mg |
| P-861539259 | Combi-Blocks | Building Block on demand | 95 | Main component | by synthesis |
| P-502459505 | Innovapharm | Virtual Building Blocks | 95 | Main component | by synthesis |
| P-504466035 | Innovapharm | Virtual Screening Compounds | 90 | Main component | by synthesis |
| P-502933862 | Innovapharm | Screening Compounds | 90 | Main component | in stock |
| P-492227677 | Innovapharm | Building Blocks | 95 | Main component | in stock |
| P-488555801 | InterBioScreen | Bioactive compounds | 92 | Main component | in stock |
| P-18806004 | Key Organics | Screening Compounds and Fragments | 90 | Main component | 60 mg |
| P-852434181 | Matrix Scientific | All | N/A | Main component | in stock |
| P-19021792 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
| P-491181429 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component | by synthesis |
| P-869143877 | TargetMol | Screening Compounds - synthesis | 95 | Main component | by synthesis |
| P-888647873 | TargetMol | Screening Compounds - stock amount | 95 | Main component | unavailable |
| P-33984105 | TimTec | ActiMol 6 Week | 90 | Main component | in stock |
| P-502387630 | TimTec | Building Block Collection | 90 | Main component | in stock |
| P-888578522 | TimTec | ActiMol 4 Week - On demand | 94 | Main component | by resynthesis (? - ? days) |
| P-2231991 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | Main component | 84 mg |
| P-851827241 | AmBeed | On request | N/A | Main component as a main component | by synthesis |
| P-591116957 | BLD pharm | Non-stock building blocks | 97 | Main component as a main component | by synthesis |
| P-617653818 | ChemDiv | Building Blocks on demand | 90 | Main component as a main component | by synthesis |
| P-869060356 | MedChemExpress | Building Blocks on demand | 95 | Main component as a main component | by synthesis |
| P-611381647 | Toronto Research | In stock | 90 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 223.661 |
| logP | 2.6536 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 2 |
| PSA | 76.72 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 60.7401 |
| Atoms | 25 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 10 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| 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 |
