Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3111713932
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 | 11 USD | N/A | 14 working days | Get Quote |
| 5 mg | 11 USD | N/A | 14 working days | Get Quote |
| 10 mg | 11 USD | N/A | 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-3111713932.sdf |
| SMILES | MCULE-3111713932.smiles |
| Standard InChI | MCULE-3111713932.inchi |
| InChIKey | MCULE-3111713932.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867558145 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875718332 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-597025449 | AEchem | Building blocks | 97 | As is | in stock |
| P-590398095 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-608433721 | Aldlab Chemicals | Building Block Stock | 95 | As is | 45 g |
| P-606852318 | AmBeed | In stock | N/A | As is | in stock |
| P-489119332 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596944384 | Angene | Building Blocks in stock | 98 | As is | 316.75 g |
| P-494320683 | Apollo Scientific | In Stock | 95 | As is | in stock |
| P-864098330 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-868580572 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-580273685 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-861921415 | FluoroChem | General BB | N/A | As is | in stock |
| P-505506604 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-454392775 | Key Organics | Building Blocks | 95 | As is | 100 mg |
| P-454301007 | Key Organics | Screening Compounds and Fragments | 95 | As is | 100 mg |
| P-579680881 | LabSeeker, Inc | On demand Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-856012950 | LaboTest | Screening Collection | 90 | As is | 1000 mg |
| P-860793374 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852376656 | Matrix Scientific | All | N/A | As is | in stock |
| P-854747870 | MedChemExpress | In stock Building Blocks | 95 | As is | in stock |
| P-500389915 | Pi Chemicals | Virtual Compounds | 97 | As is | by synthesis |
| P-889880415 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-596756708 | Synthonix | In-stock Building Blocks | 95 | As is | 317.75 g |
| P-502349472 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611569879 | Toronto Research | In stock | 90 | As is | in stock |
| P-868493925 | eNovation Chemicals LLC | Building Blocks in stock | 97 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 159.587 |
| logP | 2.6381 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 26.02 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 39.0834 |
| Atoms | 17 |
| Rings | 1 |
| Heavy atoms | 10 |
| Hydrogen atoms | 7 |
| Heteroatoms | 3 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
