Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4263327857
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 | 25 USD | 98 | 20 working days | Get Quote |
| 5 mg | 25 USD | 98 | 20 working days | Get Quote |
| 10 mg | 25 USD | 98 | 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.
| Name | File |
|---|---|
| SDF | MCULE-4263327857.sdf |
| SMILES | MCULE-4263327857.smiles |
| Standard InChI | MCULE-4263327857.inchi |
| InChIKey | MCULE-4263327857.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-852075437 | A2B Chem | Predominantly Building Block on demand | 98 | As is | by synthesis |
| P-894611578 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-893447550 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 641.99 g |
| P-19867742 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-436471965 | Alinda | Building Blocks | 95 | As is | 51 g |
| P-851839678 | AmBeed | On request | N/A | As is | by synthesis |
| P-597007801 | Angene | Building Blocks in stock | 98 | As is | 200 g |
| P-494345841 | Apollo Scientific | In Stock | 95 | As is | 3.75 g |
| P-889791348 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-4209316 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 25 mg |
| P-454728014 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-580416616 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-862069055 | FluoroChem | General BB | 97 | As is | in stock |
| P-579474026 | Key Organics | Screening Compounds and Fragments | 90 | As is | 100 mg |
| P-31263854 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-856044922 | LaboTest | Building Blocks | 90 | As is | unavailable |
| P-500403163 | Pi Chemicals | Virtual Compounds | 97 | As is | by synthesis |
| P-424799797 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-22636684 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-502367054 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-888440802 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-855325368 | Toronto Research | In stock | 90 | As is | in stock |
| P-449389 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 132 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 253.252 |
| logP | 4.0141 |
| H-bond acceptors | 4 |
| H-bond donors | 0 |
| Rotatable bonds | 4 |
| PSA | 62.89 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 75.0705 |
| Atoms | 30 |
| Rings | 2 |
| Heavy atoms | 19 |
| Hydrogen atoms | 11 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
