Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6587914833
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 | 50 USD | 98 | 15 working days | Get Quote |
| 5 mg | 50 USD | 98 | 15 working days | Get Quote |
| 10 mg | 50 USD | 98 | 15 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-6587914833.sdf |
| SMILES | MCULE-6587914833.smiles |
| Standard InChI | MCULE-6587914833.inchi |
| InChIKey | MCULE-6587914833.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-886652428 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-890176728 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-894624307 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-903214585 | Aaron Chemicals LLC | Predominantly Building Block | 98 | As is | 3 g |
| P-893552198 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 6.71 g |
| P-903000837 | AmBeed | In stock | N/A | As is | in stock |
| P-865928049 | Angene | Building Blocks in stock | 98 | As is | 3 g |
| P-869389818 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-902966487 | BLD pharm | In-stock building blocks | 98 | As is | 6.249 g |
| P-901530285 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-504731052 | ChemBridge | RUSH - EXPRESS PICK LIBRARY | 85 | As is | 5 mg |
| P-454757653 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-607694907 | ChemDiv | Discovery Chemistry Library | 90 | As is | 3 mg |
| P-861398225 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-34459584 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
| P-580766725 | Crea-Chim | Prepacked BB compounds with prompt delivery | 90 | As is | in stock |
| P-580777422 | Crea-Chim | Building Blocks | 90 | As is | by resynthesis (? - ? days) |
| P-580407298 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-861944043 | FluoroChem | General BB | N/A | As is | in stock |
| P-454415263 | Key Organics | Building Blocks | 97 | As is | 2.16 g |
| P-18816115 | Key Organics | Screening Compounds and Fragments | 97 | As is | 2.16 g |
| P-855400845 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-888873022 | PharmaBlock | In stock | N/A | As is | in stock |
| P-23859267 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-491129488 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-33466425 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-502343284 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-596528473 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1.012 g |
| P-1144668 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.012 g |
| P-868542466 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 228.242 |
| logP | 2.8458 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 46.53 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 65.1805 |
| Atoms | 29 |
| Rings | 2 |
| Heavy atoms | 17 |
| Hydrogen atoms | 12 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 |
