Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6888420383
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 | 47 USD | 92 | 15 working days | Get Quote |
| 5 mg | 74 USD | 90 | 19 working days | Get Quote |
| 10 mg | 94 USD | 90 | 19 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-6888420383.sdf |
| SMILES | MCULE-6888420383.smiles |
| Standard InChI | MCULE-6888420383.inchi |
| InChIKey | MCULE-6888420383.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867429619 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-596391880 | Asinex | General screening catalog | 90 | As is | 104 mg |
| P-7833041 | ChemBridge | Core Library | 90 | As is | 10 mg |
| P-5484696 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 50 mg |
| P-10626936 | ChemDiv | Discovery Chemistry Library | 90 | As is | 2 mg |
| P-502674605 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-12985713 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
| P-891638401 | Key Organics | Building Blocks | 95 | As is | 250 mg |
| P-35235039 | Maybridge | Screening Collection | 90 | As is | 101 g |
| P-895343671 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-18941553 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-902689801 | Specs | Natural Products | 80 | As is | 11 mg |
| P-896168804 | Specs | Screening Compounds | 90 | As is | 11 mg |
| P-22513100 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 150 mg |
| P-677681867 | Ultimate 3P | Express 1 | 90 | As is | unavailable |
| P-493866 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 227 mg |
| P-3243383 | VITAS M CHEMICAL LIMITED | Collections of Fragments for Fragment-based Drug Discovery | 90 | As is | 227 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 241.310 |
| logP | 3.9719 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 2 |
| PSA | 50.36 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 71.548 |
| Atoms | 28 |
| Rings | 3 |
| Heavy atoms | 17 |
| Hydrogen atoms | 11 |
| Heteroatoms | 3 |
| N/O atoms | 2 |
| 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 |
