Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4997296410
Compound
Show structures
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 | 9 USD | 98 | 20 working days | Get Quote |
| 5 mg | 9 USD | 98 | 20 working days | Get Quote |
| 10 mg | 9 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-4997296410.sdf |
| SMILES | MCULE-4997296410.smiles |
| Standard InChI | MCULE-4997296410.inchi |
| InChIKey | MCULE-4997296410.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867586837 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875745774 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-890259073 | ACS Scientific | Synthesis catalog | 97 | As is | by synthesis |
| P-615724799 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-893534027 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 409.948 g |
| P-608449800 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
| P-436451805 | Alinda | Building Blocks | 95 | As is | 2 g |
| P-851943991 | AmBeed | In stock | N/A | As is | in stock |
| P-489139049 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596976374 | Angene | Building Blocks in stock | 98 | As is | 150 g |
| P-895947385 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864111749 | AstaTech | In Stock BBs | 97 | As is | in stock |
| P-666962611 | BLD pharm | In-stock building blocks | 98 | As is | 6.25 g |
| P-504745272 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 5 mg |
| P-619932011 | ChemDiv | Building Blocks on demand | 90 | As is | by synthesis |
| P-454702425 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-868631934 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-868634553 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-868648155 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-580290161 | Debye Scientific | General Catalog | N/A | As is | by resynthesis (? - ? days) |
| P-901383781 | FluoroChem | In Stock BB | N/A | As is | 5 g |
| P-454412376 | Key Organics | Building Blocks | 97 | As is | 85.737 g |
| P-18813034 | Key Organics | Screening Compounds and Fragments | 97 | As is | 85.737 g |
| P-615646569 | LabNetwork | In stock | 95 | As is | in stock |
| P-579637605 | LabSeeker, Inc | On demand Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-852406059 | Matrix Scientific | All | N/A | As is | in stock |
| P-852424979 | Matrix Scientific | All | N/A | As is | in stock |
| P-428055481 | Maybridge | Screening Collection | 90 | As is | 4.97 kg |
| P-854748862 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-888884946 | PharmaBlock | In stock | N/A | As is | in stock |
| P-889870692 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-453913011 | Specs | Screening Compounds | 90 | As is | 336 mg |
| P-33212318 | TimTec | ActiMol 2 Week | 90 | As is | in stock |
| P-873219475 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611457013 | Toronto Research | In stock | 90 | As is | in stock |
| P-893940637 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 218.208 |
| logP | 1.0998 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 72.05 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 58.4502 |
| Atoms | 26 |
| Rings | 2 |
| Heavy atoms | 16 |
| Hydrogen atoms | 10 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| 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 |
