MCULE-7196837070
- 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 | 136 USD | 95 | 14 working days | Get Quote |
| 5 mg | 136 USD | 95 | 14 working days | Get Quote |
| 10 mg | 136 USD | 95 | 14 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-7421647648
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-7196837070.sdf |
| SMILES | MCULE-7196837070.smiles |
| Standard InChI | MCULE-7196837070.inchi |
| InChIKey | MCULE-7196837070.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886675977 | 95 | As is | in stock |
| P-889978183 | N/A | As is | by synthesis |
| P-904587697 | 95 | As is | in stock |
| P-903242079 | 95 | As is | 1000 mg |
| P-610916853 | 90 | As is | by synthesis |
| P-851766851 | N/A | As is | by synthesis |
| P-591145567 | 95 | As is | by synthesis |
| P-901541839 | 95 | As is | by synthesis |
| P-895406859 | 95 | As is | by synthesis |
| P-611553204 | 90 | As is | in stock |
| P-893738556 | 95 | As is | by synthesis |
| P-867443134 | N/A | Main component | by synthesis |
| P-894658200 | 95 | Main component | in stock |
| P-610916852 | 90 | Main component | by synthesis |
| P-851747185 | N/A | Main component | by synthesis |
| P-590949623 | 95 | Main component | by synthesis |
| P-613334486 | 95 | Main component | by synthesis |
| P-854884599 | 95 | Main component | by synthesis |
| P-855285817 | 90 | Main component | in stock |
| P-893602934 | 90 | Main component as a main component | 29.609 g |
| P-889845128 | 95 | Main component as a main component | by synthesis |
| P-905354820 | 97 | Main component as a main component | 129.25 g |
| P-905408335 | 97 | Main component as a main component | 129.25 g |
| P-895229268 | 95 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 209.070 |
| logP | 2.5748 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 48.14 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 50.2184 |
| Atoms | 22 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 10 |
| 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 |

