Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5583867808
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 | 7 USD | 98 | 16 working days | Get Quote |
| 5 mg | 13 USD | 98 | 16 working days | Get Quote |
| 10 mg | 19 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-5583867808.sdf |
| SMILES | MCULE-5583867808.smiles |
| Standard InChI | MCULE-5583867808.inchi |
| InChIKey | MCULE-5583867808.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867629054 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875792992 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869319597 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505401539 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-610974805 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 4.2 g |
| P-19884884 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-606838360 | AmBeed | In stock | N/A | As is | in stock |
| P-489211641 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596966095 | Angene | Building Blocks in stock | 98 | As is | 15 g |
| P-872726588 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-889548227 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-860056168 | AvaChem Scientific | All products | 98 | As is | by synthesis |
| P-868545007 | Axon Medchem | Axon predominantly SC catalog | 99 | As is | in stock |
| P-580721850 | BLD pharm | In-stock building blocks | 98 | As is | 4.871 g |
| P-5168099 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 25 mg |
| P-851279885 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-860800061 | Chiralstar | Chiralstar Building Blocks | 98 | As is | in stock |
| P-861472864 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-34827325 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
| P-579480379 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
| P-868078731 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-524166923 | Key Organics | Building Blocks | 95 | As is | 10 mg |
| P-854715437 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-474023819 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-878640888 | Molnova | Stock | 98 | As is | in stock |
| P-888843111 | PharmaBlock | On demand | N/A | As is | by synthesis |
| P-18875734 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-12637248 | Specs | Screening Compounds | 90 | As is | 164 mg |
| P-888649589 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
| P-869148091 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
| P-22852643 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-888493608 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-2159242 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 248 mg |
| P-615455087 | eNovation Chemicals LLC | Building Blocks in stock | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 305.394 |
| logP | 4.575 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 63.78 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 84.9457 |
| Atoms | 40 |
| Rings | 2 |
| Heavy atoms | 21 |
| Hydrogen atoms | 19 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| 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 |
