Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8817278054
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 | 93 USD | 95 | 15 working days | Get Quote |
| 5 mg | 93 USD | 95 | 15 working days | Get Quote |
| 10 mg | 93 USD | 95 | 15 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-4165074326
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-8817278054.sdf |
| SMILES | MCULE-8817278054.smiles |
| Standard InChI | MCULE-8817278054.inchi |
| InChIKey | MCULE-8817278054.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886644997 | 95 | As is | in stock |
| P-901283370 | N/A | As is | in stock |
| P-869319629 | 95 | As is | in stock |
| P-903204164 | 95 | As is | 10 g |
| P-893457434 | 90 | As is | 19.809 g |
| P-851734140 | N/A | As is | by synthesis |
| P-489213796 | 97 | As is | in stock |
| P-864219248 | 95 | As is | by synthesis |
| P-619596588 | 95 | As is | by synthesis |
| P-901421526 | 95 | As is | by synthesis |
| P-851273319 | 95 | As is | by synthesis |
| P-861495900 | 95 | As is | by synthesis |
| P-862264486 | 95 | As is | 9 g |
| P-563494611 | 95 | As is | 1000 mg |
| P-25839977 | 95 | As is | 12.033 g |
| P-601052533 | 90 | As is | 12.033 g |
| P-852508300 | N/A | As is | in stock |
| P-895332591 | 95 | As is | by synthesis |
| P-855216534 | 90 | As is | in stock |
| P-886969678 | 95 | As is | by synthesis |
| P-892852782 | 98 | Main component | in stock |
| P-901255585 | N/A | Main component | in stock |
| P-894665163 | 95 | Main component | in stock |
| P-606837812 | N/A | Main component | in stock |
| P-489210516 | 97 | Main component | in stock |
| P-864219247 | 95 | Main component | by synthesis |
| P-901918278 | 95 | Main component | 1.228 g |
| P-851273318 | 95 | Main component | by synthesis |
| P-870586176 | 98 | Main component | in stock |
| P-854776998 | 95 | Main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 239.739 |
| logP | 3.2646 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 21.26 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 71.4267 |
| Atoms | 34 |
| Rings | 3 |
| Heavy atoms | 16 |
| Hydrogen atoms | 18 |
| Heteroatoms | 3 |
| N/O atoms | 2 |
| 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 |
