Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8032313647
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 | 43 USD | 98 | 20 working days | Get Quote |
| 5 mg | 43 USD | 98 | 20 working days | Get Quote |
| 10 mg | 43 USD | 98 | 20 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-9421359374
- Component type: Main
-
1
MCULE-6872461833
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-8032313647.sdf |
| SMILES | MCULE-8032313647.smiles |
| Standard InChI | MCULE-8032313647.inchi |
| InChIKey | MCULE-8032313647.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886536852 | 95 | Main component | in stock |
| P-889903986 | N/A | Main component | by synthesis |
| P-869302137 | 95 | Main component | in stock |
| P-903042116 | 98 | Main component | 15 g |
| P-893601049 | 90 | Main component | 44.014 g |
| P-851496555 | N/A | Main component | by synthesis |
| P-888814426 | 98 | Main component | 15 g |
| P-889780778 | 95 | Main component | in stock |
| P-611115999 | 95 | Main component | by synthesis |
| P-901423546 | 95 | Main component | by synthesis |
| P-861394163 | 95 | Main component | by synthesis |
| P-889335447 | 95 | Main component | 19.014 g |
| P-895224315 | 95 | Main component | in stock |
| P-901177272 | 90 | Main component | 50 mg |
| P-906892389 | 98 | Main component | by synthesis |
| P-611590134 | 90 | Main component | in stock |
| P-894009712 | 95 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 200.186 |
| logP | 0.9387 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 4 |
| PSA | 49.36 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 52.1505 |
| Atoms | 28 |
| Rings | 1 |
| Heavy atoms | 15 |
| Hydrogen atoms | 13 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 1 |
| 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 |
