MCULE-4373614474
- 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 | 13 USD | 95 | 22 working days | Get Quote |
| 5 mg | 13 USD | 95 | 22 working days | Get Quote |
| 10 mg | 13 USD | 95 | 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-7904720763
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-4373614474.sdf |
| SMILES | MCULE-4373614474.smiles |
| Standard InChI | MCULE-4373614474.inchi |
| InChIKey | MCULE-4373614474.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-896613137 | 95 | As is | by synthesis |
| P-867584726 | 95 | Main component | in stock |
| P-875742824 | 95 | Main component | in stock |
| P-588247204 | 94 | Main component | by resynthesis (? - ? days) |
| P-903072981 | 95 | Main component | 20 g |
| P-893577848 | 90 | Main component | 41.086 g |
| P-1270290682 | 97 | Main component | in stock |
| P-606834513 | N/A | Main component | in stock |
| P-489167049 | 97 | Main component | in stock |
| P-597008185 | 98 | Main component | 10 g |
| P-494310261 | 95 | Main component | by resynthesis (? - ? days) |
| P-889565842 | 98 | Main component | in stock |
| P-871193948 | 97 | Main component | 1.25 g |
| P-851318732 | 95 | Main component | by synthesis |
| P-887081920 | 97 | Main component | in stock |
| P-580426379 | 95 | Main component | by resynthesis (? - ? days) |
| P-905342265 | 95 | Main component | 500 mg |
| P-862017789 | 95 | Main component | 11.086 g |
| P-596585377 | 97 | Main component | 1000 mg |
| P-31178764 | 90 | Main component | 200 mg |
| P-580514722 | 97 | Main component | in stock |
| P-1272567955 | 97 | Main component | 500 mg |
| P-852392610 | 97 | Main component | by synthesis |
| P-872795333 | 95 | Main component | in stock |
| P-888902528 | N/A | Main component | in stock |
| P-500404019 | 98 | Main component | by synthesis |
| P-889866080 | 95 | Main component | by synthesis |
| P-502398532 | 90 | Main component | in stock |
| P-906772949 | 97 | Main component | by synthesis |
| P-611393545 | 90 | Main component | in stock |
| P-611491819 | 90 | Main component | in stock |
| P-1271707906 | 97 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 237.647 |
| logP | 4.0035 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 12.03 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 58.3087 |
| Atoms | 26 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 11 |
| Heteroatoms | 5 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 4 |
| 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 |

