Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1023656722
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 | 34 USD | 97 | 20 working days | Get Quote |
| 5 mg | 34 USD | 97 | 20 working days | Get Quote |
| 10 mg | 34 USD | 97 | 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-1023656722.sdf |
| SMILES | MCULE-1023656722.smiles |
| Standard InChI | MCULE-1023656722.inchi |
| InChIKey | MCULE-1023656722.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867556485 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875715757 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869209520 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-610909400 | Advanced ChemBlocks Inc (AChemBlock) | On demand | 90 | As is | by synthesis |
| P-856048612 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
| P-675225457 | Allbio Pharm | Backorder | 95 | As is | by resynthesis (? - ? days) |
| P-867707679 | AmBeed | In stock | N/A | As is | in stock |
| P-489137957 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-619167157 | Angene | Building Blocks in stock | 97 | As is | 1.25 g |
| P-494419800 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864128292 | AstaTech | In Stock BBs | 93 | As is | in stock |
| P-613176595 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
| P-851271093 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868619693 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-580299341 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-855911061 | Key Organics | Building Blocks | 95 | As is | 1000 mg |
| P-856090093 | LabSeeker, Inc | Stock Collection | 95 | As is | in stock |
| P-613318850 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-855401972 | MedChemExpress | In stock Building Blocks | 95 | As is | in stock |
| P-888847400 | PharmaBlock | On demand | N/A | As is | by synthesis |
| P-500411342 | Pi Chemicals | Virtual Compounds | 95 | As is | by synthesis |
| P-615397843 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 164.244 |
| logP | 2.4017 |
| H-bond acceptors | 1 |
| H-bond donors | 0 |
| Rotatable bonds | 1 |
| PSA | 17.07 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 48.589 |
| Atoms | 28 |
| Rings | 3 |
| Heavy atoms | 12 |
| Hydrogen atoms | 16 |
| Heteroatoms | 1 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 4 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 4 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
