Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6403528439-0
Structure
Show compound
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 | 33 USD | 90 | 19 working days | Get Quote |
| 5 mg | 35 USD | 95 | 14 working days | Get Quote |
| 10 mg | 41 USD | 95 | 14 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-6403528439-0.sdf |
| SMILES | MCULE-6403528439-0.smiles |
| Standard InChI | MCULE-6403528439-0.inchi |
| InChIKey | MCULE-6403528439-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867593677 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875753150 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-615711075 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-19959274 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-436447084 | Alinda | Building Blocks | 95 | As is | 15 g |
| P-851746718 | AmBeed | On request | N/A | As is | by synthesis |
| P-895095117 | Angene | Building Blocks in stock | 97 | As is | 5.7 g |
| P-590947555 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
| P-492247826 | ChemBridge | Building Block Library | 95 | As is | in stock |
| P-4301158 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 5 mg |
| P-454693417 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-868634403 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
| P-34488698 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
| P-862038048 | FluoroChem | General BB | 95 | As is | in stock |
| P-492222643 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-563678272 | Key Organics | Building Blocks | 95 | As is | 100 mg |
| P-852397405 | Matrix Scientific | All | N/A | As is | in stock |
| P-854921768 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-492286025 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 5.05 g |
| P-12962126 | Otava | In-House Stock Library | 90 | As is | 5.05 g |
| P-23846673 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885517826 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-22816433 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-502338939 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-888432849 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-611434603 | Toronto Research | In stock | 90 | As is | in stock |
| P-3231246 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1.256 g |
| P-882938 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.256 g |
| P-3242032 | VITAS M CHEMICAL LIMITED | Collections of Fragments for Fragment-based Drug Discovery | 90 | As is | 1.256 g |
| P-893677172 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 226.269 |
| logP | 3.3865 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 4 |
| PSA | 26.3 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 67.7745 |
| Atoms | 31 |
| Rings | 2 |
| Heavy atoms | 17 |
| Hydrogen atoms | 14 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 |
