Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5592629788
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 | 11 USD | 95 | 22 working days | Get Quote |
| 5 mg | 23 USD | 95 | 22 working days | Get Quote |
| 10 mg | 29 USD | 95 | 7 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-5592629788.sdf |
| SMILES | MCULE-5592629788.smiles |
| Standard InChI | MCULE-5592629788.inchi |
| InChIKey | MCULE-5592629788.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867557225 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875716275 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-892783810 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-903044513 | Aaron Chemicals LLC | Predominantly Building Block | 97 | As is | 10 g |
| P-893618480 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 10.2 g |
| P-893298750 | Allbio Pharm | Backorder | 95 | As is | by resynthesis (? - ? days) |
| P-606886120 | AmBeed | In stock | N/A | As is | in stock |
| P-596943762 | Angene | Building Blocks in stock | 97 | As is | 13 g |
| P-895930175 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864173373 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-580700132 | BLD pharm | In-stock building blocks | 98 | As is | 2.83 g |
| P-893224227 | Biosynth | In Stock | 95 | As is | in stock |
| P-861286711 | Chiralstar | Chiralstar Building Blocks | 98 | As is | in stock |
| P-901650121 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-868661522 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
| P-901408240 | FluoroChem | General BB | N/A | As is | in stock |
| P-870652213 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-856009789 | Key Organics | Biochemicals | 95 | As is | 100 mg |
| P-31252264 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-854715322 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-896628236 | MedChemExpress | Screening compounds on demand | 95 | As is | by synthesis |
| P-474021471 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-619672835 | Molnova | Stock | 98 | As is | in stock |
| P-885546361 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-617401925 | Selleck Biotechnology GmbH | Product Catalog | N/A | As is | in stock |
| P-594273881 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892295445 | TargetMol | In Stock BB | 95 | As is | unavailable |
| P-888656501 | TargetMol | Screening Compounds - stock amount | 95 | As is | 25 mg |
| P-22506544 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 168 mg |
| P-611380005 | Toronto Research | In stock | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 260.249 |
| logP | 2.0218 |
| H-bond acceptors | 7 |
| H-bond donors | 1 |
| Rotatable bonds | 6 |
| PSA | 92.74 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 69.4137 |
| Atoms | 31 |
| Rings | 2 |
| Heavy atoms | 19 |
| Hydrogen atoms | 12 |
| Heteroatoms | 7 |
| N/O atoms | 7 |
| 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 |
