MCULE-2691750895
- 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 | 19 USD | 92 | 18 working days | Get Quote |
| 5 mg | 29 USD | 92 | 18 working days | Get Quote |
| 10 mg | 36 USD | 92 | 18 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-7693123644
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-2691750895.sdf |
| SMILES | MCULE-2691750895.smiles |
| Standard InChI | MCULE-2691750895.inchi |
| InChIKey | MCULE-2691750895.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867638498 | 95 | As is | in stock |
| P-875804029 | N/A | As is | in stock |
| P-612938052 | 95 | As is | in stock |
| P-903160976 | 95 | As is | 6 g |
| P-893594543 | 90 | As is | 1.41075 kg |
| P-872713753 | N/A | As is | in stock |
| P-875890737 | 95 | As is | 7 g |
| P-889780596 | 95 | As is | in stock |
| P-872717845 | 95 | As is | 6 g |
| P-901451503 | 95 | As is | by synthesis |
| P-616226001 | 95 | As is | in stock |
| P-4144884 | 90 | As is | 100 mg |
| P-851327451 | 95 | As is | by synthesis |
| P-868573627 | 98 | As is | in stock |
| P-905312395 | 95 | As is | in stock |
| P-488552224 | 90 | As is | in stock |
| P-24444457 | 95 | As is | 300 mg |
| P-454342766 | 85 | As is | 37.327 g |
| P-454412078 | 85 | As is | 37.327 g |
| P-852385081 | N/A | As is | in stock |
| P-854869314 | 95 | As is | by synthesis |
| P-454372834 | 92 | As is | in stock |
| P-674652314 | 92 | As is | 300 mg |
| P-906810076 | 95 | As is | by synthesis |
| P-611598400 | 90 | As is | in stock |
| P-852100627 | 95 | Main component | by synthesis |
| P-889928849 | N/A | Main component | by synthesis |
| P-904520019 | 95 | Main component | in stock |
| P-851617018 | N/A | Main component | by synthesis |
| P-590909224 | 98 | Main component | by synthesis |
| P-901462749 | 95 | Main component | by synthesis |
| P-851257042 | 95 | Main component | by synthesis |
| P-861338956 | 95 | Main component | by synthesis |
| P-502536489 | 95 | Main component | by synthesis |
| P-588711728 | 95 | Main component | unavailable |
| P-852529160 | N/A | Main component | in stock |
| P-869013539 | 95 | Main component | by synthesis |
| P-491079326 | 95 | Main component | by synthesis |
| P-520091111 | 90 | Main component | in stock |
| P-502380220 | 90 | Main component | in stock |
| P-464683220 | 90 | Main component | 1.01 g |
| P-2631669 | 90 | Main component | 1.01 g |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 207.696 |
| logP | 2.077 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 40.54 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 58.8108 |
| Atoms | 31 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 18 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| 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 |

