Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6379896074-0
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 | 5 USD | 97 | 16 working days | Get Quote |
| 5 mg | 5 USD | 97 | 16 working days | Get Quote |
| 10 mg | 5 USD | 97 | 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.
-
1
MCULE-2148745069-1
- Component type: Main
-
1
MCULE-7728164114-0
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-6379896074-0.sdf |
| SMILES | MCULE-6379896074-0.smiles |
| Standard InChI | MCULE-6379896074-0.inchi |
| InChIKey | MCULE-6379896074-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867569769 | A2B Chem | Predominantly Building Block in stock | 97 | As is | in stock |
| P-875730027 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-505389436 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-505394762 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-580247670 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
| P-851944090 | AmBeed | In stock | N/A | As is | in stock |
| P-489203677 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596949052 | Angene | Building Blocks in stock | 97 | As is | 525 g |
| P-864196072 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-860055426 | AvaChem Scientific | All products | 98 | As is | by synthesis |
| P-619338747 | ChemDiv | Discovery Chemistry Library | 90 | As is | 28 mg |
| P-578048941 | Chemfaces | Natural Compounds | 98 | As is | in stock |
| P-579477615 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
| P-889117640 | FluoroChem | In Stock BB | N/A | As is | 7.302 kg |
| P-500418029 | Glentham Life Sciences | Compounds maintained in stock | N/A | As is | in stock |
| P-608219251 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-524167337 | Key Organics | Building Blocks | 95 | As is | 250 g |
| P-856006138 | Key Organics | Screening Compounds and Fragments | 95 | As is | 100 mg |
| P-31194905 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-856045738 | LaboTest | Building Blocks | 90 | As is | unavailable |
| P-854713662 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-584624961 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-888172427 | Molnova | On demand | 98 | As is | by synthesis |
| P-889868595 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-617403113 | Selleckchem | Product Catalog | N/A | As is | in stock |
| P-869178383 | TargetMol | Natural Products | 95 | As is | 96.649 g |
| P-502366281 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-873055789 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 4 mg |
| P-855011854 | Toronto Research | In stock | 90 | As is | in stock |
| P-617778567 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 27 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 479.007 |
| logP | 2.565 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 7 |
| PSA | 56.69 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 142.6283 |
| Atoms | 65 |
| Rings | 4 |
| Heavy atoms | 34 |
| Hydrogen atoms | 31 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
