Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8328860853
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 | 7 USD | 96 | 22 working days | Get Quote |
| 5 mg | 7 USD | 96 | 22 working days | Get Quote |
| 10 mg | 7 USD | 96 | 22 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-7234022591
- Component type: Main
-
1
MCULE-6152801555
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-8328860853.sdf |
| SMILES | MCULE-8328860853.smiles |
| Standard InChI | MCULE-8328860853.inchi |
| InChIKey | MCULE-8328860853.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-856040621 | 90 | As is | 2 g |
| P-31276903 | 90 | As is | 2 g |
| P-893180524 | N/A | Main component | by synthesis |
| P-867565761 | 96 | Main component | in stock |
| P-875725316 | N/A | Main component | in stock |
| P-869186858 | 95 | Main component | in stock |
| P-590394267 | 98 | Main component | in stock |
| P-903054019 | 96 | Main component | 152 kg |
| P-851931578 | N/A | Main component | in stock |
| P-895930810 | 95 | Main component | by resynthesis (? - ? days) |
| P-868612769 | 96 | Main component | in stock |
| P-580442613 | 95 | Main component | by resynthesis (? - ? days) |
| P-896534754 | 97 | Main component | 1.574 kg |
| P-488550531 | 90 | Main component | in stock |
| P-596588181 | 90 | Main component | 500 g |
| P-579626156 | 96 | Main component | unavailable |
| P-31273874 | 90 | Main component | 10 g |
| P-856040643 | 90 | Main component | 10 g |
| P-454368871 | 92 | Main component | in stock |
| P-885523918 | 95 | Main component | by synthesis |
| P-579331057 | 90 | Main component | in stock |
| P-502368088 | 90 | Main component | in stock |
| P-906850492 | 95 | Main component | by synthesis |
| P-855014631 | 90 | Main component | in stock |
| P-3228222 | 90 | Main component | unavailable |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 341.315 |
| logP | 0.0558 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 11 |
| PSA | 4.44 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 88.6977 |
| Atoms | 48 |
| Rings | 0 |
| Heavy atoms | 16 |
| Hydrogen atoms | 32 |
| 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 |
