MCULE-7174766340-0
- 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 | 39 USD | 90 | 22 working days | Get Quote |
| 5 mg | 57 USD | 90 | 22 working days | Get Quote |
| 10 mg | 72 USD | 90 | 22 working days | Get Quote |
- 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-6981898149-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-7174766340-0.sdf |
| SMILES | MCULE-7174766340-0.smiles |
| Standard InChI | MCULE-7174766340-0.inchi |
| InChIKey | MCULE-7174766340-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886824720 | 95 | As is | in stock |
| P-890099624 | N/A | As is | by synthesis |
| P-903435398 | 95 | As is | 1000 mg |
| P-1263676379 | N/A | As is | by synthesis |
| P-1263329657 | 95 | As is | by synthesis |
| P-675255326 | 95 | As is | by synthesis |
| P-893724891 | 95 | As is | by synthesis |
| P-852180790 | N/A | Main component | by synthesis |
| P-894622765 | 95 | Main component | in stock |
| P-617128081 | 90 | Main component | by synthesis |
| P-619930283 | 90 | Main component | by synthesis |
| P-612204728 | 90 | Main component | 73 mg |
| P-612673927 | 90 | Main component | in stock |
| P-905311119 | 98 | Main component | 7.5 g |
| P-888159941 | 95 | Main component | by synthesis |
| P-852469466 | N/A | Main component | in stock |
| P-633711911 | 90 | Main component | by synthesis |
| P-500379308 | 98 | Main component | by synthesis |
| P-19068395 | 90 | Main component | in stock |
| P-903747886 | 94 | Main component | by resynthesis (? - ? days) |
| P-790529 | 90 | Main component | 69 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 365.293 |
| logP | 3.8368 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 5 |
| PSA | 23.55 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 108.206 |
| Atoms | 46 |
| Rings | 3 |
| Heavy atoms | 24 |
| Hydrogen atoms | 22 |
| Heteroatoms | 5 |
| N/O atoms | 3 |
| 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 |

