Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7848329858-0
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 | 90 USD | 95 | 25 working days | Get Quote |
| 5 mg | 90 USD | 95 | 25 working days | Get Quote |
| 10 mg | 90 USD | 95 | 25 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-2900139119-0
- Component type: Main
-
1
MCULE-6647815245-2
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-7848329858-0.sdf |
| SMILES | MCULE-7848329858-0.smiles |
| Standard InChI | MCULE-7848329858-0.inchi |
| InChIKey | MCULE-7848329858-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-675475654 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-851998578 | LeadGen Labs | In-stock compounds | 96 | As is | in stock |
| P-886629474 | A2B Chem | Predominantly Building Block in stock | 95 | Main component | in stock |
| P-875813501 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-612934840 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-851624287 | AmBeed | On request | N/A | Main component | by synthesis |
| P-596517834 | Asinex | General bb catalog | 90 | Main component | 1000 mg |
| P-596457260 | Asinex | General screening catalog | 90 | Main component | 1000 mg |
| P-889805483 | AstaTech | Backordered BBs | 95 | Main component | by synthesis |
| P-590849053 | BLD pharm | Non-stock building blocks | 97 | Main component | by synthesis |
| P-492221667 | Innovapharm | Building Blocks | 95 | Main component | in stock |
| P-502478042 | Innovapharm | Virtual Building Blocks | 95 | Main component | by synthesis |
| P-852387076 | Matrix Scientific | All | N/A | Main component | in stock |
| P-854850896 | MedChemExpress | Building Blocks on demand | 95 | Main component | by synthesis |
| P-856064350 | Princeton Biomolecular Research | Building Block Stock | 95 | Main component | 5 g |
| P-23339453 | TimTec | ActiMol 6 Week | 90 | Main component | in stock |
| P-502335033 | TimTec | Building Block Collection | 90 | Main component | in stock |
| P-611609564 | Toronto Research | In stock | 90 | Main component | in stock |
| P-893771381 | eNovation Chemicals LLC | Building Block on demand | 95 | Main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 316.779 |
| logP | 2.5375 |
| H-bond acceptors | 6 |
| H-bond donors | 3 |
| Rotatable bonds | 6 |
| PSA | 103.86 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 81.328 |
| Atoms | 42 |
| Rings | 1 |
| Heavy atoms | 21 |
| Hydrogen atoms | 21 |
| Heteroatoms | 7 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
