Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5233220429
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 | 35 USD | 90 | 19 working days | Get Quote |
| 5 mg | 51 USD | 90 | 19 working days | Get Quote |
| 10 mg | 65 USD | 90 | 19 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-5233220429.sdf |
| SMILES | MCULE-5233220429.smiles |
| Standard InChI | MCULE-5233220429.inchi |
| InChIKey | MCULE-5233220429.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867308349 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
| P-889931637 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
| P-851683285 | AmBeed | On request | N/A | As is | by synthesis |
| P-590999991 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-492254267 | ChemBridge | Building Block Library | 95 | As is | in stock |
| P-454687513 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-15155539 | ChemDiv | Discovery Chemistry Library | 90 | As is | 14 mg |
| P-577092744 | Chemcia | Virtual compounds | 95 | As is | by synthesis |
| P-436444255 | Chemical Block | Building Blocks | 90 | As is | 10 g |
| P-345775 | Chemical Block | Screening Library | 90 | As is | 221 mg |
| P-861376112 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-34730989 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
| P-862040124 | FluoroChem | General BB | 95 | As is | in stock |
| P-502464563 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-467897974 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-601071967 | Life Chemicals | Screening Compounds | 90 | As is | 21 mg |
| P-852507728 | Matrix Scientific | All | N/A | As is | in stock |
| P-895291355 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-24066274 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-33494875 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-502340990 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-873036665 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 5 mg |
| P-611590962 | Toronto Research | In stock | 90 | As is | in stock |
| P-2375787 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 110 mg |
| P-886926641 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 195.600 |
| logP | 1.5641 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 0 |
| PSA | 37.38 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 52.0675 |
| Atoms | 19 |
| Rings | 2 |
| Heavy atoms | 13 |
| Hydrogen atoms | 6 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
