Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3121441561-0
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 | 34 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-3121441561-0.sdf |
| SMILES | MCULE-3121441561-0.smiles |
| Standard InChI | MCULE-3121441561-0.inchi |
| InChIKey | MCULE-3121441561-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-886513200 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-889897484 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
| P-869204889 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-893395720 | Advanced ChemBlocks Inc (AChemBlock) | On demand | 90 | As is | by synthesis |
| P-436477296 | Alinda | Building Blocks | 95 | As is | in stock |
| P-851416548 | AmBeed | On request | N/A | As is | by synthesis |
| P-889809806 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-590752651 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-454736919 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-619832420 | ChemDiv | Discovery Chemistry Library | 90 | As is | 12 mg |
| P-861526017 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-34603033 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
| P-580781575 | Crea-Chim | Building Blocks | 95 | As is | by resynthesis (? - ? days) |
| P-861297811 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
| P-580770518 | Crea-Chim | Prepacked BB compounds with prompt delivery | 95 | As is | in stock |
| P-862039587 | FluoroChem | General BB | 95 | As is | in stock |
| P-492236754 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-502569361 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-488554464 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-427867005 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
| P-596598109 | Key Organics | Building Blocks | 90 | As is | 1000 mg |
| P-580479090 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852535933 | Matrix Scientific | All | N/A | As is | in stock |
| P-895327094 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-454375014 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-445299613 | Pharmeks LLC | Synthetic compounds | 92 | As is | 300 mg |
| P-23883588 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-596796675 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-33469112 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-502346820 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611441199 | Toronto Research | In stock | 90 | As is | in stock |
| P-1237800 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.05 g |
| P-464690879 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1.05 g |
| P-893853546 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 138.167 |
| logP | 1.0128 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 2 |
| PSA | 34.89 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 38.4905 |
| Atoms | 20 |
| Rings | 1 |
| Heavy atoms | 10 |
| Hydrogen atoms | 10 |
| 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 |
