Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3033721942-0
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 | 25 USD | 95 | 14 working days | Get Quote |
| 5 mg | 25 USD | 95 | 14 working days | Get Quote |
| 10 mg | 25 USD | 95 | 14 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-2664344908-0
- Component type: Main
-
2
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-3033721942-0.sdf |
| SMILES | MCULE-3033721942-0.smiles |
| Standard InChI | MCULE-3033721942-0.inchi |
| InChIKey | MCULE-3033721942-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886675969 | 95 | As is | in stock |
| P-889978176 | N/A | As is | by synthesis |
| P-894658795 | 95 | As is | in stock |
| P-903242071 | 95 | As is | 1000 mg |
| P-893389811 | 90 | As is | by synthesis |
| P-851605850 | N/A | As is | by synthesis |
| P-889810664 | 95 | As is | by synthesis |
| P-590848010 | 95 | As is | by synthesis |
| P-901541871 | 95 | As is | by synthesis |
| P-861384367 | 95 | As is | by synthesis |
| P-854851579 | 95 | As is | by synthesis |
| P-611549318 | 90 | As is | in stock |
| P-893738530 | 95 | As is | by synthesis |
| P-612847718 | N/A | Main component | by synthesis |
| P-901186256 | N/A | Main component | by synthesis |
| P-590393450 | 95 | Main component | in stock |
| P-903070189 | 95 | Main component | 10 g |
| P-905482915 | 95 | Main component | 1000 mg |
| P-893504604 | 90 | Main component | 23.683 g |
| P-580242785 | 95 | Main component | by synthesis |
| P-606903287 | N/A | Main component | in stock |
| P-489206747 | 97 | Main component | in stock |
| P-596952484 | 95 | Main component | 2.033 g |
| P-895927870 | 95 | Main component | by resynthesis (? - ? days) |
| P-864104047 | 95 | Main component | in stock |
| P-902965419 | 95 | Main component | by synthesis |
| P-851247689 | 95 | Main component | by synthesis |
| P-861277869 | 95 | Main component | in stock |
| P-861438179 | 95 | Main component | by synthesis |
| P-580410908 | 95 | Main component | by resynthesis (? - ? days) |
| P-862000529 | 95 | Main component | 2.033 g |
| P-855376380 | 90 | Main component | unavailable |
| P-505549115 | 95 | Main component | in stock |
| P-502571027 | 95 | Main component | by synthesis |
| P-500157855 | 96 | Main component | in stock |
| P-454423241 | 95 | Main component | 1000 mg |
| P-615652927 | 95 | Main component | in stock |
| P-852496009 | N/A | Main component | in stock |
| P-854764453 | 95 | Main component | by synthesis |
| P-873286155 | N/A | Main component | in stock |
| P-33221353 | 90 | Main component | in stock |
| P-888225905 | 90 | Main component | 7 mg |
| P-906898762 | 95 | Main component | in stock |
| P-906870063 | 95 | Main component | by synthesis |
| P-906870064 | 97 | Main component | by synthesis |
| P-906838404 | 95 | Main component | by synthesis |
| P-611575269 | 90 | Main component | in stock |
| P-893944880 | 95 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 244.159 |
| logP | 2.2274 |
| H-bond acceptors | 4 |
| H-bond donors | 3 |
| Rotatable bonds | 3 |
| PSA | 67.15 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 64.8498 |
| Atoms | 33 |
| Rings | 1 |
| Heavy atoms | 14 |
| Hydrogen atoms | 19 |
| Heteroatoms | 6 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
