Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3447274756
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 | 39 USD | 95 | 11 working days | Get Quote |
| 5 mg | 64 USD | 97 | 20 working days | Get Quote |
| 10 mg | 84 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-3447274756.sdf |
| SMILES | MCULE-3447274756.smiles |
| Standard InChI | MCULE-3447274756.inchi |
| InChIKey | MCULE-3447274756.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867646628 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875814216 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869246122 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-610955333 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 12.94 g |
| P-851927010 | AmBeed | In stock | N/A | As is | in stock |
| P-489207615 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-619180860 | Angene | Building Blocks in stock | 97 | As is | 370 mg |
| P-580195713 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-851278862 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-860799547 | Chiralstar | Chiralstar Building Blocks | 98 | As is | in stock |
| P-887234299 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-608496615 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
| P-675215862 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-855916279 | Key Organics | Building Blocks | 97 | As is | 10 mg |
| P-854716509 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-474023775 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-608277198 | Molnova | Stock | 98 | As is | in stock |
| P-579712936 | Selleckchem | Product Catalog | N/A | As is | in stock |
| P-888649819 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
| P-869148627 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
| P-611438404 | Toronto Research | In stock | 90 | As is | in stock |
| P-611429709 | Toronto Research | In stock | 90 | As is | in stock |
| P-886923134 | eNovation Chemicals LLC | Building Block on demand | 97 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 547.530 |
| logP | 6.3555 |
| H-bond acceptors | 9 |
| H-bond donors | 2 |
| Rotatable bonds | 7 |
| PSA | 103.35 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 150.9579 |
| Atoms | 64 |
| Rings | 5 |
| Heavy atoms | 40 |
| Hydrogen atoms | 24 |
| Heteroatoms | 12 |
| N/O atoms | 9 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| 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 |
