Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7585389399
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 | 35 USD | 90 | 19 working days | Get Quote |
| 5 mg | 46 USD | 95 | 17 working days | Get Quote |
| 10 mg | 46 USD | 95 | 17 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.
-
MCULE-5416945957
- Component type: Main
-
MCULE-1891065471
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-7585389399.sdf |
| SMILES | MCULE-7585389399.smiles |
| Standard InChI | MCULE-7585389399.inchi |
| InChIKey | MCULE-7585389399.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867407547 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-612935829 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-489228757 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-870024727 | Asinex | General screening catalog | 90 | As is | unavailable |
| P-596589311 | Key Organics | Building Blocks | 90 | As is | 5 g |
| P-468057358 | Life Chemicals | Building Blocks | 95 | As is | 264 mg |
| P-25758267 | Life Chemicals | Screening Compounds | 90 | As is | 264 mg |
| P-588250646 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852384211 | Matrix Scientific | All | N/A | As is | in stock |
| P-869024716 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-19120040 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-33464510 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-502331489 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-888355640 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-855233642 | Toronto Research | In stock | 90 | As is | in stock |
| P-3231013 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 9.099 g |
| P-24874958 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 9.099 g |
| P-852097528 | A2B Chem | Predominantly Building Block on demand | N/A | As a main component | by synthesis |
| P-875793946 | AA Blocks | AA Blocks - in stock | N/A | As a main component | in stock |
| P-617652641 | ChemDiv | Building Blocks in stock | 90 | As a main component | in stock |
| P-619826388 | ChemDiv | Discovery Chemistry Library | 90 | As a main component | 21 mg |
| P-861377257 | Combi-Blocks | Building Block on demand | 95 | As a main component | by synthesis |
| P-278331989 | Crea-Chim | HTS compounds | 90 | As a main component | by resynthesis (? - ? days) |
| P-580784867 | Crea-Chim | Building Blocks | 95 | As a main component | by resynthesis (? - ? days) |
| P-580772177 | Crea-Chim | Prepacked BB compounds with prompt delivery | 95 | As a main component | in stock |
| P-862059489 | FluoroChem | General BB | N/A | As a main component | in stock |
| P-580495882 | Manchester Organics | Compounds on demand | 95 | As a main component | by synthesis |
| P-852607054 | Matrix Scientific | All | N/A | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 212.290 |
| logP | 2.8048 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 5 |
| PSA | 24.92 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 66.1057 |
| Atoms | 32 |
| Rings | 2 |
| Heavy atoms | 16 |
| Hydrogen atoms | 16 |
| Heteroatoms | 2 |
| 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 |
