Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7809293254
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-2602222760
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-7809293254.sdf |
| SMILES | MCULE-7809293254.smiles |
| Standard InChI | MCULE-7809293254.inchi |
| InChIKey | MCULE-7809293254.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-886684378 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875849272 | AA Blocks | AA Blocks | N/A | As is | in stock |
| P-869366595 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-861389641 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-596593140 | Key Organics | Building Blocks | 90 | As is | 500 mg |
| P-852393031 | Matrix Scientific | All | N/A | As is | in stock |
| P-885527875 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-424823823 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-502385141 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611394435 | Toronto Research | In stock | 90 | As is | in stock |
| P-1125452 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 3.341 g |
| P-867549413 | A2B Chem | Predominantly Building Block in stock | 95 | Main component | in stock |
| P-875706611 | AA Blocks | AA Blocks | N/A | Main component | in stock |
| P-492253829 | ChemBridge | Building Block Library | 95 | Main component | in stock |
| P-861375600 | Combi-Blocks | Building Block on demand | 95 | Main component | by synthesis |
| P-862039932 | FluoroChem | General BB | N/A | Main component | in stock |
| P-855946393 | Key Organics | Building Blocks | 95 | Main component | 1000 mg |
| P-19490472 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
| P-611587000 | Toronto Research | In stock | 90 | Main component | in stock |
| P-1125300 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | Main component | 149 mg |
| P-886893103 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 225.756 |
| logP | 3.9542 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 12.03 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 67.9027 |
| Atoms | 35 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 20 |
| Heteroatoms | 2 |
| N/O atoms | 1 |
| 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 |
