Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9698617573
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 | 39 USD | 95 | 11 working days | Get Quote |
| 5 mg | 62 USD | 98 | 16 working days | Get Quote |
| 10 mg | 100 USD | 98 | 16 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.
-
MCULE-5266222752
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-9698617573.sdf |
| SMILES | MCULE-9698617573.smiles |
| Standard InChI | MCULE-9698617573.inchi |
| InChIKey | MCULE-9698617573.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867556729 | A2B Chem | Predominantly Building Block in stock | 98 | As a main component | in stock |
| P-875716031 | AA Blocks | AA Blocks - in stock | N/A | As a main component | in stock |
| P-878259894 | AmBeed | In stock | N/A | As a main component | in stock |
| P-489177069 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As a main component | in stock |
| P-865906614 | Angene | Building Blocks in stock | 98 | As a main component | 2 g |
| P-872725831 | Apexbio Technology | Bioactive Compound Library | 98 | As a main component | in stock |
| P-889585627 | AstaTech | In Stock BBs | 95 | As a main component | in stock |
| P-878233684 | BLD pharm | In-stock building blocks | 95 | As a main component | 2 g |
| P-887190390 | Combi-Blocks | Building Block on demand | 95 | As a main component | by synthesis |
| P-580272083 | Debye Scientific | General Catalog | 95 | As a main component | by resynthesis (? - ? days) |
| P-855918679 | Key Organics | Building Blocks | 97 | As a main component | 10 mg |
| P-854712272 | MedChemExpress | Screening compounds In stock | 95 | As a main component | in stock |
| P-878644558 | Molnova | Stock | 98 | As a main component | in stock |
| P-873282374 | Shanghai iChemical | In stock | N/A | As a main component | in stock |
| P-888641553 | TargetMol | Screening Compounds | 95 | As a main component | by synthesis |
| P-869129108 | TargetMol | Screening Compounds - stock amount | 95 | As a main component | in stock |
| P-868539036 | eNovation Chemicals LLC | Building Blocks in stock | 98 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 548.715 |
| logP | 3.948 |
| H-bond acceptors | 8 |
| H-bond donors | 0 |
| Rotatable bonds | 15 |
| PSA | 74.76 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 163.3748 |
| Atoms | 84 |
| Rings | 4 |
| Heavy atoms | 40 |
| Hydrogen atoms | 44 |
| Heteroatoms | 8 |
| N/O atoms | 8 |
| 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 |
