Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6517225229
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 | 6 USD | 97 | 22 working days | Get Quote |
| 5 mg | 7 USD | 97 | 22 working days | Get Quote |
| 10 mg | 7 USD | 97 | 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.
| Name | File |
|---|---|
| SDF | MCULE-6517225229.sdf |
| SMILES | MCULE-6517225229.smiles |
| Standard InChI | MCULE-6517225229.inchi |
| InChIKey | MCULE-6517225229.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867576674 | A2B Chem | Predominantly Building Block in stock | 97 | As is | in stock |
| P-875737313 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869189853 | AK Scientific | Building Blocks | 97 | As is | in stock |
| P-505352722 | AK Scientific | Building Blocks | 99 | As is | in stock |
| P-893518007 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 965.1 g |
| P-606838092 | AmBeed | In stock | N/A | As is | in stock |
| P-489138641 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596931009 | Angene | Building Blocks in stock | 95 | As is | 400 g |
| P-864155718 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-580712927 | BLD pharm | In-stock building blocks | 97 | As is | 182.1 g |
| P-893230908 | Biosynth | In Stock | 95 | As is | in stock |
| P-851266627 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868600847 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
| P-580416321 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-889116886 | FluoroChem | In Stock BB | N/A | As is | 5 g |
| P-503624770 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
| P-524199581 | Key Organics | Building Blocks | 95 | As is | 25 g |
| P-524163273 | Key Organics | Building Blocks | 98 | As is | 1000 mg |
| P-855997375 | Key Organics | Screening Compounds and Fragments | 95 | As is | 100 mg |
| P-615655582 | LabNetwork | In stock | 95 | As is | in stock |
| P-613363007 | LabSeeker, Inc | Stock Collection | 97 | As is | in stock |
| P-856079683 | LabSeeker, Inc | On demand Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-854691215 | MedChemExpress | Natural Products In stock | 95 | As is | in stock |
| P-619672966 | Molnova | Stock | 98 | As is | in stock |
| P-500399780 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-885541428 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-617403475 | Selleck Biotechnology GmbH | Product Catalog | N/A | As is | in stock |
| P-865965226 | Synthonix | In-stock Building Blocks | 97 | As is | 774.51 g |
| P-594274278 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892295823 | TargetMol | In Stock BB | 95 | As is | unavailable |
| P-892338209 | TargetMol | Screening Compounds - stock amount | 95 | As is | 149 mg |
| P-22541344 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 974 mg |
| P-611415143 | Toronto Research | In stock | 90 | As is | in stock |
| P-615451906 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 118.131 |
| logP | 0.0879 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 2 |
| PSA | 57.53 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 29.0826 |
| Atoms | 18 |
| Rings | 0 |
| Heavy atoms | 8 |
| Hydrogen atoms | 10 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
