Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8346438764-1
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 | 10 USD | 98 | 20 working days | Get Quote |
| 5 mg | 10 USD | 98 | 20 working days | Get Quote |
| 10 mg | 10 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-8346438764-1.sdf |
| SMILES | MCULE-8346438764-1.smiles |
| Standard InChI | MCULE-8346438764-1.inchi |
| InChIKey | MCULE-8346438764-1.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-489191749 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596942717 | Angene | Building Blocks in stock | 98 | As is | 150 g |
| P-872724704 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-893235198 | Biosynth | In Stock | 95 | As is | in stock |
| P-851268206 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-901406469 | FluoroChem | General BB | N/A | As is | in stock |
| P-579625537 | LabSeeker, Inc | Stock Collection | 99 | As is | in stock |
| P-896627436 | MedChemExpress | Screening compounds on demand | 95 | As is | by synthesis |
| P-854719409 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-888171683 | Molnova | On demand | 98 | As is | by synthesis |
| P-885536315 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-579710482 | Selleck Biotechnology GmbH | Product Catalog | N/A | As is | in stock |
| P-525184111 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-888657693 | TargetMol | Screening Compounds - stock amount | 95 | As is | 98 mg |
| P-893964575 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 249.266 |
| logP | 2.603 |
| H-bond acceptors | 6 |
| H-bond donors | 2 |
| Rotatable bonds | 6 |
| PSA | 76.24 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 67.9864 |
| Atoms | 33 |
| Rings | 2 |
| Heavy atoms | 18 |
| Hydrogen atoms | 15 |
| Heteroatoms | 6 |
| N/O atoms | 6 |
| 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 |
