Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6441637565
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 | 8 USD | 96 | 6 working days | Get Quote |
| 5 mg | 8 USD | 96 | 6 working days | Get Quote |
| 10 mg | 8 USD | 96 | 6 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.
-
MCULE-7291931764
- Component type: Main
-
MCULE-4988958825
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-6441637565.sdf |
| SMILES | MCULE-6441637565.smiles |
| Standard InChI | MCULE-6441637565.inchi |
| InChIKey | MCULE-6441637565.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886543348 | 97 | As a main component | in stock |
| P-901257561 | N/A | As a main component | in stock |
| P-590412913 | 95 | As a main component | in stock |
| P-903050266 | 97 | As a main component | 30 g |
| P-893604712 | 90 | As a main component | 17.243 g |
| P-851412441 | N/A | As a main component | by synthesis |
| P-851829846 | N/A | As a main component | by synthesis |
| P-864175703 | 98 | As a main component | in stock |
| P-590994078 | 97 | As a main component | by synthesis |
| P-619598483 | 98 | As a main component | by synthesis |
| P-619327432 | 90 | As a main component | 94 mg |
| P-868611794 | 98 | As a main component | in stock |
| P-889441282 | 96 | As a main component | 528 mg |
| P-905410359 | 98 | As a main component | 2.242 g |
| P-905361212 | 96 | As a main component | 100 mg |
| P-31178249 | 90 | As a main component | 200 mg |
| P-31178308 | 90 | As a main component | 30 mg |
| P-25838260 | 90 | As a main component | 375 mg |
| P-131538686 | 90 | As a main component | 833 mg |
| P-854756718 | 95 | As a main component | in stock |
| P-885536087 | 95 | As a main component | by synthesis |
| P-868523938 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 417.613 |
| logP | 6.1322 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 6 |
| PSA | 65.29 |
| RO5 violations | 1 |
| RO3 violations | 4 |
| Refractivity | 131.918 |
| Atoms | 54 |
| Rings | 4 |
| Heavy atoms | 29 |
| Hydrogen atoms | 25 |
| Heteroatoms | 4 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| 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 |
