Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8288165685
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 | 33 USD | 90 | 17 working days | Get Quote |
| 5 mg | 50 USD | 90 | 17 working days | Get Quote |
| 10 mg | 64 USD | 90 | 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.
-
1
MCULE-5655008186
- Component type: Main
-
1
MCULE-5889111640
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-8288165685.sdf |
| SMILES | MCULE-8288165685.smiles |
| Standard InChI | MCULE-8288165685.inchi |
| InChIKey | MCULE-8288165685.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-13705595 | Pharmeks LLC | Natural & unique compounds | 92 | As is | 3 mg |
| P-851502794 | AmBeed | On request | N/A | Main component | by synthesis |
| P-596490922 | Asinex | General bb catalog | 90 | Main component | 1000 mg |
| P-596391031 | Asinex | General screening catalog | 90 | Main component | 1000 mg |
| P-590837905 | BLD pharm | Non-stock building blocks | 97 | Main component | by synthesis |
| P-141084 | Chemical Block | Screening Library | 90 | Main component | 96 mg |
| P-34679414 | Crea-Chim | HTS compounds | 90 | Main component | by resynthesis (? - ? days) |
| P-852382368 | Matrix Scientific | All | N/A | Main component | in stock |
| P-864030932 | MedChemExpress | Building Blocks on demand | 95 | Main component | by synthesis |
| P-24032000 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
| P-502331670 | TimTec | Building Block Collection | 90 | Main component | in stock |
| P-22494146 | TimTec | ActiMol 1 Week - Stock | 90 | Main component | 5 mg |
| P-2127848 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | Main component | 101 mg |
| P-427936107 | InterBioScreen | Natural Compounds | 92 | Main component as a main component | 80 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 285.336 |
| logP | 1.7607 |
| H-bond acceptors | 6 |
| H-bond donors | 3 |
| Rotatable bonds | 3 |
| PSA | 103.7 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 77.7583 |
| Atoms | 43 |
| Rings | 2 |
| Heavy atoms | 20 |
| Hydrogen atoms | 23 |
| Heteroatoms | 6 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 3 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 3 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
